methyl 2-[6-methoxy-9-(phenylsulfonyl)-1,2,3,4-tetrahydropyrido[3,4-b]indol-1-yl]ethanoate

Systemtic Name: methyl 2-[6-methoxy-9-(phenylsulfonyl)-1,2,3,4-tetrahydropyrido[3,4-b]indol-1-yl]ethanoate Openeye Name: methyl 2-[9-(benzenesulfonyl)-6-methoxy-1,2,3,4-tetrahydropyrido[3,4-b]indol-1-yl]acetate CAS Name: 2-[9-(benzenesulfonyl)-6-methoxy-1,2,3,4-tetrahydropyrido[3,4-b]indol-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[9-(benzenesulfonyl)-6-methoxy-1,2,3,4-tetrahydropyrido[3,4-b]indol-1-yl]acetate Traditional Name: 2-(9-besyl-6-methoxy-1,2,3,4-tetrahydro-$b-carbolin-1-yl)acetic acid methyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C3=C2CCNC3CC(=O)OC)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N(C3=C2CCNC3CC(=O)OC)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O5S/c1-27-14-8-9-19-17(12-14)16-10-11-22-18(13-20(24)28-2)21(16)23(19)29(25,26)15-6-4-3-5-7-15/h3-9,12,18,22H,10-11,13H2,1-2H3