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

Systemtic Name: 2-[5-(ethylamino)-3-methoxycarbonyl-1,6-dimethyl-4,7-bis(oxidanylidene)indol-2-yl]prop-2-enoic acid Openeye Name: 2-[5-(ethylamino)-3-methoxycarbonyl-1,6-dimethyl-4,7-dioxo-indol-2-yl]prop-2-enoic acid CAS Name: 2-[5-(ethylamino)-3-methoxycarbonyl-1,6-dimethyl-4,7-dioxo-2-indolyl]-2-propenoic acid IUPAC Name: 2-[5-(ethylamino)-3-methoxycarbonyl-1,6-dimethyl-4,7-dioxoindol-2-yl]prop-2-enoic acid Traditional Name: 2-[3-carbomethoxy-5-(ethylamino)-4,7-diketo-1,6-dimethyl-indol-2-yl]acrylic acid Formula: C17H18N2O6 MolecularWeight: 346.33462

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C(=O)C2=C(C1=O)C(=C(N2C)C(=C)C(=O)O)C(=O)OC)C

Isomeric SMILES

CCNC1=C(C(=O)C2=C(C1=O)C(=C(N2C)C(=C)C(=O)O)C(=O)OC)C

InChI

InChI=1S/C17H18N2O6/c1-6-18-11-7(2)14(20)13-9(15(11)21)10(17(24)25-5)12(19(13)4)8(3)16(22)23/h18H,3,6H2,1-2,4-5H3,(H,22,23)