(E)-N-[2-(4-chlorophenyl)benzotriazol-5-yl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(4-chlorophenyl)benzotriazol-5-yl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[2-(4-chlorophenyl)benzotriazol-5-yl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[2-(4-chlorophenyl)-5-benzotriazolyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[2-(4-chlorophenyl)benzotriazol-5-yl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[2-(4-chlorophenyl)benzotriazol-5-yl]-3-(3-nitrophenyl)acrylamide Formula: C21H14ClN5O3 MolecularWeight: 419.82056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)NC2=CC3=NN(N=C3C=C2)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)NC2=CC3=NN(N=C3C=C2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H14ClN5O3/c22-15-5-8-17(9-6-15)26-24-19-10-7-16(13-20(19)25-26)23-21(28)11-4-14-2-1-3-18(12-14)27(29)30/h1-13H,(H,23,28)/b11-4+