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4-[3-[(4-butoxycarbonylphenyl)amino]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoic acid

4-[3-[(4-butoxycarbonylphenyl)amino]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoic acid

Systemtic Name:4-[3-[(4-butoxycarbonylphenyl)amino]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoic acid
Openeye Name:4-[3-(4-butoxycarbonylanilino)-2,5-dioxo-pyrrolidin-1-yl]benzoic acid
CAS Name:4-[3-[4-[butoxy(oxo)methyl]anilino]-2,5-dioxo-1-pyrrolidinyl]benzoic acid
IUPAC Name:4-[3-(4-butoxycarbonylanilino)-2,5-dioxopyrrolidin-1-yl]benzoic acid
Traditional Name:4-[3-(4-butoxycarbonylanilino)-2,5-diketo-pyrrolidino]benzoic acid
Formula: C22H22N2O6
MolecularWeight: 410.41988
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)O


Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)O


InChI

InChI=1S/C22H22N2O6/c1-2-3-12-30-22(29)15-4-8-16(9-5-15)23-18-13-19(25)24(20(18)26)17-10-6-14(7-11-17)21(27)28/h4-11,18,23H,2-3,12-13H2,1H3,(H,27,28)


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