methyl 1-(4-azanyl-3-methoxy-phenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate

Systemtic Name: methyl 1-(4-azanyl-3-methoxy-phenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate Openeye Name: methyl 1-(4-amino-3-methoxy-phenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate CAS Name: 1-(4-amino-3-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylic acid methyl ester IUPAC Name: methyl 1-(4-amino-3-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate Traditional Name: 1-(4-amino-3-methoxy-phenyl)-1,3,4,9-tetrahydro-$b-carboline-2-carboxylic acid methyl ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C3=C(CCN2C(=O)OC)C4=CC=CC=C4N3)N

Isomeric SMILES

COC1=C(C=CC(=C1)C2C3=C(CCN2C(=O)OC)C4=CC=CC=C4N3)N

InChI

InChI=1S/C20H21N3O3/c1-25-17-11-12(7-8-15(17)21)19-18-14(9-10-23(19)20(24)26-2)13-5-3-4-6-16(13)22-18/h3-8,11,19,22H,9-10,21H2,1-2H3