2-[2-[4-[1-[2-(7,7a-dihydropyrido[4,3-c]carbazol-7-ium-2-yl)ethyl]piperidin-4-yl]piperidin-1-yl]ethyl]-7,7a-dihydropyrido[4,3-c]carbazol-7-ium dichloride

Systemtic Name: 2-[2-[4-[1-[2-(7,7a-dihydropyrido[4,3-c]carbazol-7-ium-2-yl)ethyl]piperidin-4-yl]piperidin-1-yl]ethyl]-7,7a-dihydropyrido[4,3-c]carbazol-7-ium dichloride Openeye Name: 2-[2-[4-[1-[2-(7,7a-dihydropyrido[4,3-c]carbazol-7-ium-2-yl)ethyl]-4-piperidyl]-1-piperidyl]ethyl]-7,7a-dihydropyrido[4,3-c]carbazol-7-ium dichloride CAS Name: 2-[2-[4-[1-[2-(7,7a-dihydropyrido[4,3-c]carbazol-7-ium-2-yl)ethyl]-4-piperidinyl]-1-piperidinyl]ethyl]-7,7a-dihydropyrido[4,3-c]carbazol-7-ium dichloride IUPAC Name: 2-[2-[4-[1-[2-(7,7a-dihydropyrido[4,3-c]carbazol-7-ium-2-yl)ethyl]piperidin-4-yl]piperidin-1-yl]ethyl]-7,7a-dihydropyrido[4,3-c]carbazol-7-ium dichloride Traditional Name: 2-[2-[4-[1-[2-(7,7a-dihydropyrido[4,3-c]carbazol-7-ium-2-yl)ethyl]-4-piperidyl]piperidino]ethyl]-7,7a-dihydropyrido[4,3-c]carbazol-7-ium dichloride Formula: C44H50Cl2N6 MolecularWeight: 733.814

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2CCN(CC2)CCN3C=CC4=CC=C5C(=C6C=CC=CC6[NH2+]5)C4=C3)CCN7C=CC8=CC=C9C(=C1C=CC=CC1[NH2+]9)C8=C7.[Cl-].[Cl-]

Isomeric SMILES

C1CN(CCC1C2CCN(CC2)CCN3C=CC4=CC=C5C(=C6C=CC=CC6[NH2+]5)C4=C3)CCN7C=CC8=CC=C9C(=C1C=CC=CC1[NH2+]9)C8=C7.[Cl-].[Cl-]

InChI

InChI=1S/C44H48N6.2ClH/c1-3-7-39-35(5-1)43-37-29-49(23-17-33(37)9-11-41(43)45-39)27-25-47-19-13-31(14-20-47)32-15-21-48(22-16-32)26-28-50-24-18-34-10-12-42-44(38(34)30-50)36-6-2-4-8-40(36)46-42;;/h1-12,17-18,23-24,29-32,39-40,45-46H,13-16,19-22,25-28H2;2*1H