N-[(E)-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]-4-nitro-aniline

Systemtic Name: N-[(E)-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]-4-nitro-aniline Openeye Name: N-[(E)-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-4-nitro-aniline CAS Name: N-[(E)-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]methylideneamino]-4-nitroaniline IUPAC Name: N-[(E)-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)methylideneamino]-4-nitroaniline Traditional Name: [(E)-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-(4-nitrophenyl)amine Formula: C18H16ClN5O2 MolecularWeight: 369.80494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC2=CC=C(C=C2)[N+](=O)[O-])Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC2=CC=C(C=C2)[N+](=O)[O-])Cl)CC3=CC=CC=C3

InChI

InChI=1S/C18H16ClN5O2/c1-13-17(11-20-21-15-7-9-16(10-8-15)24(25)26)18(19)23(22-13)12-14-5-3-2-4-6-14/h2-11,21H,12H2,1H3/b20-11+