2-[5-methoxy-3-methoxycarbonyl-1,6-dimethyl-4,7-bis(oxidanylidene)indol-2-yl]prop-2-enoic acid

Systemtic Name: 2-[5-methoxy-3-methoxycarbonyl-1,6-dimethyl-4,7-bis(oxidanylidene)indol-2-yl]prop-2-enoic acid Openeye Name: 2-(5-methoxy-3-methoxycarbonyl-1,6-dimethyl-4,7-dioxo-indol-2-yl)prop-2-enoic acid CAS Name: 2-(5-methoxy-3-methoxycarbonyl-1,6-dimethyl-4,7-dioxo-2-indolyl)-2-propenoic acid IUPAC Name: 2-(5-methoxy-3-methoxycarbonyl-1,6-dimethyl-4,7-dioxoindol-2-yl)prop-2-enoic acid Traditional Name: 2-(3-carbomethoxy-4,7-diketo-5-methoxy-1,6-dimethyl-indol-2-yl)acrylic acid Formula: C16H15NO7 MolecularWeight: 333.2928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(C1=O)N(C(=C2C(=O)OC)C(=C)C(=O)O)C)OC

Isomeric SMILES

CC1=C(C(=O)C2=C(C1=O)N(C(=C2C(=O)OC)C(=C)C(=O)O)C)OC

InChI

InChI=1S/C16H15NO7/c1-6(15(20)21)10-9(16(22)24-5)8-11(17(10)3)12(18)7(2)14(23-4)13(8)19/h1H2,2-5H3,(H,20,21)