2-[2-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]ethanoylamino]benzoic acid

Systemtic Name: 2-[2-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]ethanoylamino]benzoic acid Openeye Name: 2-[[2-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidyl]acetyl]amino]benzoic acid CAS Name: 2-[[1-oxo-2-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]ethyl]amino]benzoic acid IUPAC Name: 2-[[2-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]acetyl]amino]benzoic acid Traditional Name: 2-[[2-[4-(2-keto-4H-3,1-benzoxazin-1-yl)piperidino]acetyl]amino]benzoic acid Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3COC2=O)CC(=O)NC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3COC2=O)CC(=O)NC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C22H23N3O5/c26-20(23-18-7-3-2-6-17(18)21(27)28)13-24-11-9-16(10-12-24)25-19-8-4-1-5-15(19)14-30-22(25)29/h1-8,16H,9-14H2,(H,23,26)(H,27,28)