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

Systemtic Name: 3-[[1,4-bis(oxidanylidene)-3-piperidin-1-yl-naphthalen-2-yl]amino]benzoic acid Openeye Name: 3-[[1,4-dioxo-3-(1-piperidyl)-2-naphthyl]amino]benzoic acid CAS Name: 3-[[1,4-dioxo-3-(1-piperidinyl)-2-naphthalenyl]amino]benzoic acid IUPAC Name: 3-[(1,4-dioxo-3-piperidin-1-ylnaphthalen-2-yl)amino]benzoic acid Traditional Name: 3-[(1,4-diketo-3-piperidino-2-naphthyl)amino]benzoic acid Formula: C22H20N2O4 MolecularWeight: 376.4052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C22H20N2O4/c25-20-16-9-2-3-10-17(16)21(26)19(24-11-4-1-5-12-24)18(20)23-15-8-6-7-14(13-15)22(27)28/h2-3,6-10,13,23H,1,4-5,11-12H2,(H,27,28)