methyl 2-[6-methoxy-2-(phenylmethyl)-9-(phenylsulfonyl)-3,4-dihydro-1H-pyrido[3,4-b]indol-1-yl]ethanoate

Systemtic Name: methyl 2-[6-methoxy-2-(phenylmethyl)-9-(phenylsulfonyl)-3,4-dihydro-1H-pyrido[3,4-b]indol-1-yl]ethanoate Openeye Name: methyl 2-[9-(benzenesulfonyl)-2-benzyl-6-methoxy-3,4-dihydro-1H-pyrido[3,4-b]indol-1-yl]acetate CAS Name: 2-[9-(benzenesulfonyl)-6-methoxy-2-(phenylmethyl)-3,4-dihydro-1H-pyrido[3,4-b]indol-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[9-(benzenesulfonyl)-2-benzyl-6-methoxy-3,4-dihydro-1H-pyrido[3,4-b]indol-1-yl]acetate Traditional Name: 2-(2-benzyl-9-besyl-6-methoxy-3,4-dihydro-1H-$b-carbolin-1-yl)acetic acid methyl ester Formula: C28H28N2O5S MolecularWeight: 504.59732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C3=C2CCN(C3CC(=O)OC)CC4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)N(C3=C2CCN(C3CC(=O)OC)CC4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H28N2O5S/c1-34-21-13-14-25-24(17-21)23-15-16-29(19-20-9-5-3-6-10-20)26(18-27(31)35-2)28(23)30(25)36(32,33)22-11-7-4-8-12-22/h3-14,17,26H,15-16,18-19H2,1-2H3