3-cyclopentyl-1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]propan-1-one; ethanedioic acid

Systemtic Name: 3-cyclopentyl-1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]propan-1-one; ethanedioic acid Openeye Name: 3-cyclopentyl-1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]propan-1-one; oxalic acid CAS Name: 3-cyclopentyl-1-[4-[(9-ethyl-3-carbazolyl)methyl]-1-piperazinyl]-1-propanone; oxalic acid IUPAC Name: 3-cyclopentyl-1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]propan-1-one; oxalic acid Traditional Name: 3-cyclopentyl-1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazino]propan-1-one; oxalic acid Formula: C29H37N3O5 MolecularWeight: 507.62118

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)CN3CCN(CC3)C(=O)CCC4CCCC4)C5=CC=CC=C51.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)CN3CCN(CC3)C(=O)CCC4CCCC4)C5=CC=CC=C51.C(=O)(C(=O)O)O

InChI

InChI=1S/C27H35N3O.C2H2O4/c1-2-30-25-10-6-5-9-23(25)24-19-22(11-13-26(24)30)20-28-15-17-29(18-16-28)27(31)14-12-21-7-3-4-8-21;3-1(4)2(5)6/h5-6,9-11,13,19,21H,2-4,7-8,12,14-18,20H2,1H3;(H,3,4)(H,5,6)