(E)-N-(6-chloranyl-2-phenyl-benzotriazol-5-yl)-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(6-chloranyl-2-phenyl-benzotriazol-5-yl)-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(6-chloro-2-phenyl-benzotriazol-5-yl)-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-(6-chloro-2-phenyl-5-benzotriazolyl)-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(6-chloro-2-phenylbenzotriazol-5-yl)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(6-chloro-2-phenyl-benzotriazol-5-yl)-3-(3-nitrophenyl)acrylamide Formula: C21H14ClN5O3 MolecularWeight: 419.82056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)/C=C/C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H14ClN5O3/c22-17-12-19-20(25-26(24-19)15-6-2-1-3-7-15)13-18(17)23-21(28)10-9-14-5-4-8-16(11-14)27(29)30/h1-13H,(H,23,28)/b10-9+