methyl 2-[5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3,3-dimethyl-2-oxidanylidene-indol-1-yl]ethanoate

Systemtic Name: methyl 2-[5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3,3-dimethyl-2-oxidanylidene-indol-1-yl]ethanoate Openeye Name: methyl 2-[5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3,3-dimethyl-2-oxo-indolin-1-yl]acetate CAS Name: 2-[5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3,3-dimethyl-2-oxo-1-indolyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3,3-dimethyl-2-oxoindol-1-yl]acetate Traditional Name: 2-[5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-keto-3,3-dimethyl-indolin-1-yl]acetic acid methyl ester Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)N(C1=O)CC(=O)OC)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)N(C1=O)CC(=O)OC)C

InChI

InChI=1S/C22H24N2O5S/c1-22(2)18-12-17(8-9-19(18)24(21(22)26)14-20(25)29-3)30(27,28)23-11-10-15-6-4-5-7-16(15)13-23/h4-9,12H,10-11,13-14H2,1-3H3