N-[(3-chlorophenyl)methyl]-1-phenethyl-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-1-phenethyl-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-[(3-chlorophenyl)methyl]-1-phenethyl-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: N-[(3-chlorophenyl)methyl]-1-phenethyl-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-[(3-chlorophenyl)methyl]-1-phenethyl-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-(3-chlorobenzyl)-1-phenethyl-9H-$b-carboline-3-carboxamide Formula: C27H22ClN3O MolecularWeight: 439.93608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=C3C(=CC(=N2)C(=O)NCC4=CC(=CC=C4)Cl)C5=CC=CC=C5N3

Isomeric SMILES

C1=CC=C(C=C1)CCC2=C3C(=CC(=N2)C(=O)NCC4=CC(=CC=C4)Cl)C5=CC=CC=C5N3

InChI

InChI=1S/C27H22ClN3O/c28-20-10-6-9-19(15-20)17-29-27(32)25-16-22-21-11-4-5-12-23(21)31-26(22)24(30-25)14-13-18-7-2-1-3-8-18/h1-12,15-16,31H,13-14,17H2,(H,29,32)