N-[(3-chlorophenyl)methyl]-1-(2-ethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-1-(2-ethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-[(3-chlorophenyl)methyl]-1-(2-ethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: N-[(3-chlorophenyl)methyl]-1-(2-ethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-[(3-chlorophenyl)methyl]-1-(2-ethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-(3-chlorobenzyl)-1-o-phenetyl-9H-$b-carboline-3-carboxamide Formula: C27H22ClN3O2 MolecularWeight: 455.93548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=C3C(=CC(=N2)C(=O)NCC4=CC(=CC=C4)Cl)C5=CC=CC=C5N3

Isomeric SMILES

CCOC1=CC=CC=C1C2=C3C(=CC(=N2)C(=O)NCC4=CC(=CC=C4)Cl)C5=CC=CC=C5N3

InChI

InChI=1S/C27H22ClN3O2/c1-2-33-24-13-6-4-11-20(24)25-26-21(19-10-3-5-12-22(19)30-26)15-23(31-25)27(32)29-16-17-8-7-9-18(28)14-17/h3-15,30H,2,16H2,1H3,(H,29,32)