butanedioic acid; 3-(2-dimethylaminoethyl)-N-(4-pyridin-4-ylphenyl)-1H-indole-5-carboxamide

Systemtic Name: butanedioic acid; 3-(2-dimethylaminoethyl)-N-(4-pyridin-4-ylphenyl)-1H-indole-5-carboxamide Openeye Name: 3-(2-dimethylaminoethyl)-N-[4-(4-pyridyl)phenyl]-1H-indole-5-carboxamide; succinic acid CAS Name: butanedioic acid; 3-(2-dimethylaminoethyl)-N-(4-pyridin-4-ylphenyl)-1H-indole-5-carboxamide IUPAC Name: butanedioic acid; 3-(2-dimethylaminoethyl)-N-(4-pyridin-4-ylphenyl)-1H-indole-5-carboxamide Traditional Name: 3-(2-dimethylaminoethyl)-N-[4-(4-pyridyl)phenyl]-1H-indole-5-carboxamide; succinic acid Formula: C52H54N8O6 MolecularWeight: 887.03516

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=CNC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=CC=NC=C4.CN(C)CCC1=CNC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=CC=NC=C4.C(CC(=O)O)C(=O)O

Isomeric SMILES

CN(C)CCC1=CNC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=CC=NC=C4.CN(C)CCC1=CNC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=CC=NC=C4.C(CC(=O)O)C(=O)O

InChI

InChI=1S/2C24H24N4O.C4H6O4/c2*1-28(2)14-11-20-16-26-23-8-5-19(15-22(20)23)24(29)27-21-6-3-17(4-7-21)18-9-12-25-13-10-18;5-3(6)1-2-4(7)8/h2*3-10,12-13,15-16,26H,11,14H2,1-2H3,(H,27,29);1-2H2,(H,5,6)(H,7,8)