2-(benzotriazol-1-yl)-2-[(E)-phenacylideneamino]ethanoic acid

Systemtic Name: 2-(benzotriazol-1-yl)-2-[(E)-phenacylideneamino]ethanoic acid Openeye Name: 2-(benzotriazol-1-yl)-2-[(E)-phenacylideneamino]acetic acid CAS Name: 2-(1-benzotriazolyl)-2-[(E)-phenacylideneamino]acetic acid IUPAC Name: 2-(benzotriazol-1-yl)-2-[(E)-phenacylideneamino]acetic acid Traditional Name: 2-(benzotriazol-1-yl)-2-[(E)-phenacylideneamino]acetic acid Formula: C16H12N4O3 MolecularWeight: 308.29148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C=NC(C(=O)O)N2C3=CC=CC=C3N=N2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)/C=N/C(C(=O)O)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H12N4O3/c21-14(11-6-2-1-3-7-11)10-17-15(16(22)23)20-13-9-5-4-8-12(13)18-19-20/h1-10,15H,(H,22,23)/b17-10+