1-(4-ethoxy-3-methoxy-phenyl)-N-(3-imidazol-1-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: 1-(4-ethoxy-3-methoxy-phenyl)-N-(3-imidazol-1-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-(4-ethoxy-3-methoxy-phenyl)-N-(3-imidazol-1-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(4-ethoxy-3-methoxyphenyl)-N-[3-(1-imidazolyl)propyl]-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-(4-ethoxy-3-methoxyphenyl)-N-(3-imidazol-1-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(4-ethoxy-3-methoxy-phenyl)-N-(3-imidazol-1-ylpropyl)-9H-$b-carboline-3-carboxamide Formula: C27H27N5O3 MolecularWeight: 469.53498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=C3C(=CC(=N2)C(=O)NCCCN4C=CN=C4)C5=CC=CC=C5N3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=C3C(=CC(=N2)C(=O)NCCCN4C=CN=C4)C5=CC=CC=C5N3)OC

InChI

InChI=1S/C27H27N5O3/c1-3-35-23-10-9-18(15-24(23)34-2)25-26-20(19-7-4-5-8-21(19)30-26)16-22(31-25)27(33)29-11-6-13-32-14-12-28-17-32/h4-5,7-10,12,14-17,30H,3,6,11,13H2,1-2H3,(H,29,33)