methyl 3-[1-(1,3-benzodioxol-5-yl)-2-[(2-methoxy-4-methyl-phenyl)sulfonylamino]-2-oxidanylidene-ethyl]-1-methyl-indole-6-carboxylate

Systemtic Name: methyl 3-[1-(1,3-benzodioxol-5-yl)-2-[(2-methoxy-4-methyl-phenyl)sulfonylamino]-2-oxidanylidene-ethyl]-1-methyl-indole-6-carboxylate Openeye Name: methyl 3-[1-(1,3-benzodioxol-5-yl)-2-[(2-methoxy-4-methyl-phenyl)sulfonylamino]-2-oxo-ethyl]-1-methyl-indole-6-carboxylate CAS Name: 3-[1-(1,3-benzodioxol-5-yl)-2-[(2-methoxy-4-methylphenyl)sulfonylamino]-2-oxoethyl]-1-methyl-6-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-[1-(1,3-benzodioxol-5-yl)-2-[(2-methoxy-4-methylphenyl)sulfonylamino]-2-oxoethyl]-1-methylindole-6-carboxylate Traditional Name: 3-[1-(1,3-benzodioxol-5-yl)-2-keto-2-[(2-methoxy-4-methyl-phenyl)sulfonylamino]ethyl]-1-methyl-indole-6-carboxylic acid methyl ester Formula: C28H26N2O8S MolecularWeight: 550.57964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NC(=O)C(C2=CC3=C(C=C2)OCO3)C4=CN(C5=C4C=CC(=C5)C(=O)OC)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NC(=O)C(C2=CC3=C(C=C2)OCO3)C4=CN(C5=C4C=CC(=C5)C(=O)OC)C)OC

InChI

InChI=1S/C28H26N2O8S/c1-16-5-10-25(24(11-16)35-3)39(33,34)29-27(31)26(17-7-9-22-23(13-17)38-15-37-22)20-14-30(2)21-12-18(28(32)36-4)6-8-19(20)21/h5-14,26H,15H2,1-4H3,(H,29,31)