N-(2-butyl-1,2,3,4-tetrazol-5-yl)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enamide

Systemtic Name: N-(2-butyl-1,2,3,4-tetrazol-5-yl)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enamide Openeye Name: N-(2-butyltetrazol-5-yl)-3-(4-chloro-3-nitro-phenyl)prop-2-enamide CAS Name: N-(2-butyl-5-tetrazolyl)-3-(4-chloro-3-nitrophenyl)-2-propenamide IUPAC Name: N-(2-butyltetrazol-5-yl)-3-(4-chloro-3-nitrophenyl)prop-2-enamide Traditional Name: N-(2-butyltetrazol-5-yl)-3-(4-chloro-3-nitro-phenyl)acrylamide Formula: C14H15ClN6O3 MolecularWeight: 350.7603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1N=C(N=N1)NC(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCN1N=C(N=N1)NC(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H15ClN6O3/c1-2-3-8-20-18-14(17-19-20)16-13(22)7-5-10-4-6-11(15)12(9-10)21(23)24/h4-7,9H,2-3,8H2,1H3,(H,16,18,22)