4-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]-3-methyl-3-nitroso-2,4-bis(oxidanylidene)butanoic acid

Systemtic Name: 4-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]-3-methyl-3-nitroso-2,4-bis(oxidanylidene)butanoic acid Openeye Name: 4-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-3-methyl-3-nitroso-2,4-dioxo-butanoic acid CAS Name: 4-[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]-3-methyl-3-nitroso-2,4-dioxobutanoic acid IUPAC Name: 4-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-3-methyl-3-nitroso-2,4-dioxobutanoic acid Traditional Name: 4-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-2,4-diketo-3-methyl-3-nitroso-butyric acid Formula: C22H17ClN2O7 MolecularWeight: 456.83258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)C(=O)C(C)(C(=O)C(=O)O)N=O

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)C(=O)C(C)(C(=O)C(=O)O)N=O

InChI

InChI=1S/C22H17ClN2O7/c1-11-17(18(26)22(2,24-31)19(27)21(29)30)15-10-14(32-3)8-9-16(15)25(11)20(28)12-4-6-13(23)7-5-12/h4-10H,1-3H3,(H,29,30)