(9-ethylcarbazol-3-yl)methyl-[2-(2-oxidanylpropylazaniumyl)ethyl]azanium dichloride

Systemtic Name: (9-ethylcarbazol-3-yl)methyl-[2-(2-oxidanylpropylazaniumyl)ethyl]azanium dichloride Openeye Name: (9-ethylcarbazol-3-yl)methyl-[2-(2-hydroxypropylammonio)ethyl]ammonium dichloride CAS Name: (9-ethyl-3-carbazolyl)methyl-[2-(2-hydroxypropylammonio)ethyl]ammonium dichloride IUPAC Name: (9-ethylcarbazol-3-yl)methyl-[2-(2-hydroxypropylazaniumyl)ethyl]azanium dichloride Traditional Name: (9-ethylcarbazol-3-yl)methyl-[2-(2-hydroxypropylammonio)ethyl]ammonium dichloride Formula: C20H29Cl2N3O MolecularWeight: 398.36976

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C[NH2+]CC[NH2+]CC(C)O)C3=CC=CC=C31.[Cl-].[Cl-]

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C[NH2+]CC[NH2+]CC(C)O)C3=CC=CC=C31.[Cl-].[Cl-]

InChI

InChI=1S/C20H27N3O.2ClH/c1-3-23-19-7-5-4-6-17(19)18-12-16(8-9-20(18)23)14-22-11-10-21-13-15(2)24;;/h4-9,12,15,21-22,24H,3,10-11,13-14H2,1-2H3;2*1H