(Z)-3-(benzotriazol-1-yl)-4-(4-nitrophenyl)but-3-en-2-one

Systemtic Name: (Z)-3-(benzotriazol-1-yl)-4-(4-nitrophenyl)but-3-en-2-one Openeye Name: (Z)-3-(benzotriazol-1-yl)-4-(4-nitrophenyl)but-3-en-2-one CAS Name: (Z)-3-(1-benzotriazolyl)-4-(4-nitrophenyl)-3-buten-2-one IUPAC Name: (Z)-3-(benzotriazol-1-yl)-4-(4-nitrophenyl)but-3-en-2-one Traditional Name: (Z)-3-(benzotriazol-1-yl)-4-(4-nitrophenyl)but-3-en-2-one Formula: C16H12N4O3 MolecularWeight: 308.29148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=C(C=C1)[N+](=O)[O-])N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(=O)/C(=C/C1=CC=C(C=C1)[N+](=O)[O-])/N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H12N4O3/c1-11(21)16(10-12-6-8-13(9-7-12)20(22)23)19-15-5-3-2-4-14(15)17-18-19/h2-10H,1H3/b16-10-