3-[4-[4-(4-methoxyphenyl)piperazin-1-yl]butyl]-1H-indole-5-carboxylic acid; 1-methyl-2H-pyridine-4-carboxamide

Systemtic Name: 3-[4-[4-(4-methoxyphenyl)piperazin-1-yl]butyl]-1H-indole-5-carboxylic acid; 1-methyl-2H-pyridine-4-carboxamide Openeye Name: 3-[4-[4-(4-methoxyphenyl)piperazin-1-yl]butyl]-1H-indole-5-carboxylic acid; 1-methyl-2H-pyridine-4-carboxamide CAS Name: 3-[4-[4-(4-methoxyphenyl)-1-piperazinyl]butyl]-1H-indole-5-carboxylic acid; 1-methyl-2H-pyridine-4-carboxamide IUPAC Name: 3-[4-[4-(4-methoxyphenyl)piperazin-1-yl]butyl]-1H-indole-5-carboxylic acid; 1-methyl-2H-pyridine-4-carboxamide Traditional Name: 3-[4-[4-(4-methoxyphenyl)piperazino]butyl]-1H-indole-5-carboxylic acid; 1-methyl-2H-pyridine-4-carboxamide Formula: C31H39N5O4 MolecularWeight: 545.67246

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC=C(C=C1)C(=O)N.COC1=CC=C(C=C1)N2CCN(CC2)CCCCC3=CNC4=C3C=C(C=C4)C(=O)O

Isomeric SMILES

CN1CC=C(C=C1)C(=O)N.COC1=CC=C(C=C1)N2CCN(CC2)CCCCC3=CNC4=C3C=C(C=C4)C(=O)O

InChI

InChI=1S/C24H29N3O3.C7H10N2O/c1-30-21-8-6-20(7-9-21)27-14-12-26(13-15-27)11-3-2-4-19-17-25-23-10-5-18(24(28)29)16-22(19)23;1-9-4-2-6(3-5-9)7(8)10/h5-10,16-17,25H,2-4,11-15H2,1H3,(H,28,29);2-4H,5H2,1H3,(H2,8,10)