methyl 2-[(1R,2R,10R,11aR)-2-methanoyl-10-methoxy-6-oxidanylidene-2-(phenylsulfinyl)-3,4,10,11-tetrahydro-1H-pyrido[2,1-i]indol-1-yl]ethanoate

Systemtic Name: methyl 2-[(1R,2R,10R,11aR)-2-methanoyl-10-methoxy-6-oxidanylidene-2-(phenylsulfinyl)-3,4,10,11-tetrahydro-1H-pyrido[2,1-i]indol-1-yl]ethanoate Openeye Name: methyl 2-[(1R,2R,10R,11aR)-2-(benzenesulfinyl)-2-formyl-10-methoxy-6-oxo-3,4,10,11-tetrahydro-1H-pyrido[2,1-i]indol-1-yl]acetate CAS Name: 2-[(1R,2R,10R,11aR)-2-(benzenesulfinyl)-2-formyl-10-methoxy-6-oxo-3,4,10,11-tetrahydro-1H-pyrido[2,1-i]indol-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(1R,2R,10R,11aR)-2-(benzenesulfinyl)-2-formyl-10-methoxy-6-oxo-3,4,10,11-tetrahydro-1H-pyrido[2,1-i]indol-1-yl]acetate Traditional Name: 2-[(1R,2R,10R,11aR)-2-(benzenesulfinyl)-2-formyl-6-keto-10-methoxy-3,4,10,11-tetrahydro-1H-pyrid[2,1-i]indol-1-yl]acetic acid methyl ester Formula: C23H25NO6S MolecularWeight: 443.5127

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC23C(C(CCN2C(=O)C=C3C=C1)(C=O)S(=O)C4=CC=CC=C4)CC(=O)OC

Isomeric SMILES

CO[C@@H]1C[C@]23[C@H]([C@](CCN2C(=O)C=C3C=C1)(C=O)S(=O)C4=CC=CC=C4)CC(=O)OC

InChI

InChI=1S/C23H25NO6S/c1-29-17-9-8-16-12-20(26)24-11-10-22(15-25,31(28)18-6-4-3-5-7-18)19(13-21(27)30-2)23(16,24)14-17/h3-9,12,15,17,19H,10-11,13-14H2,1-2H3/t17-,19-,22-,23-,31?/m0/s1