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

Systemtic Name: 3-[1-(1,3-benzodioxol-5-yl)-2-[(2-methoxy-4-methyl-phenyl)sulfonylamino]-2-oxidanylidene-ethyl]-1-methyl-indole-6-carboxylate Openeye Name: 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-indolecarboxylate IUPAC Name: 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-carboxylate Formula: C27H23N2O8S- MolecularWeight: 535.54512

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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)[O-])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)[O-])C)OC

InChI

InChI=1S/C27H24N2O8S/c1-15-4-9-24(23(10-15)35-3)38(33,34)28-26(30)25(16-6-8-21-22(12-16)37-14-36-21)19-13-29(2)20-11-17(27(31)32)5-7-18(19)20/h4-13,25H,14H2,1-3H3,(H,28,30)(H,31,32)/p-1