N-[2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-4-chloranyl-3-nitro-N-(phenylmethyl)benzamide

Systemtic Name: N-[2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-4-chloranyl-3-nitro-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-[2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-4-chloro-3-nitro-benzamide CAS Name: N-[2-[[5-tert-butyl-2-(2-chlorophenyl)-3-pyrazolyl]amino]-2-oxoethyl]-4-chloro-3-nitro-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-[2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-oxoethyl]-4-chloro-3-nitrobenzamide Traditional Name: N-benzyl-N-[2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-keto-ethyl]-4-chloro-3-nitro-benzamide Formula: C29H27Cl2N5O4 MolecularWeight: 580.46178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CN(CC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=CC=CC=C4Cl

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CN(CC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=CC=CC=C4Cl

InChI

InChI=1S/C29H27Cl2N5O4/c1-29(2,3)25-16-26(35(33-25)23-12-8-7-11-21(23)30)32-27(37)18-34(17-19-9-5-4-6-10-19)28(38)20-13-14-22(31)24(15-20)36(39)40/h4-16H,17-18H2,1-3H3,(H,32,37)