4-oxidanylidene-4-[(2-phenylbenzotriazol-5-yl)amino]butanoate

Systemtic Name: 4-oxidanylidene-4-[(2-phenylbenzotriazol-5-yl)amino]butanoate Openeye Name: 4-oxo-4-[(2-phenylbenzotriazol-5-yl)amino]butanoate CAS Name: 4-oxo-4-[(2-phenyl-5-benzotriazolyl)amino]butanoate IUPAC Name: 4-oxo-4-[(2-phenylbenzotriazol-5-yl)amino]butanoate Traditional Name: 4-keto-4-[(2-phenylbenzotriazol-5-yl)amino]butyrate Formula: C16H13N4O3- MolecularWeight: 309.29942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C16H14N4O3/c21-15(8-9-16(22)23)17-11-6-7-13-14(10-11)19-20(18-13)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H,17,21)(H,22,23)/p-1