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

Systemtic Name: 3-[[1,4-bis(oxidanylidene)-3-pyrrolidin-1-yl-naphthalen-2-yl]amino]benzoic acid Openeye Name: 3-[(1,4-dioxo-3-pyrrolidin-1-yl-2-naphthyl)amino]benzoic acid CAS Name: 3-[[1,4-dioxo-3-(1-pyrrolidinyl)-2-naphthalenyl]amino]benzoic acid IUPAC Name: 3-[(1,4-dioxo-3-pyrrolidin-1-ylnaphthalen-2-yl)amino]benzoic acid Traditional Name: 3-[(1,4-diketo-3-pyrrolidino-2-naphthyl)amino]benzoic acid Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1CCN(C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C21H18N2O4/c24-19-15-8-1-2-9-16(15)20(25)18(23-10-3-4-11-23)17(19)22-14-7-5-6-13(12-14)21(26)27/h1-2,5-9,12,22H,3-4,10-11H2,(H,26,27)