4-[[2-(2-methoxyethyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[[2-(2-methoxyethyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]-3-methyl-benzoic acid Openeye Name: 4-[[2-(2-methoxyethyl)-1,3-dioxo-isoindoline-5-carbonyl]amino]-3-methyl-benzoic acid CAS Name: 4-[[[2-(2-methoxyethyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[2-(2-methoxyethyl)-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylbenzoic acid Traditional Name: 4-[[1,3-diketo-2-(2-methoxyethyl)isoindoline-5-carbonyl]amino]-3-methyl-benzoic acid Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCOC

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCOC

InChI

InChI=1S/C20H18N2O6/c1-11-9-13(20(26)27)4-6-16(11)21-17(23)12-3-5-14-15(10-12)19(25)22(18(14)24)7-8-28-2/h3-6,9-10H,7-8H2,1-2H3,(H,21,23)(H,26,27)