N-[2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[[4-(1,1-dimethylpropyl)cyclohexyl]amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-[(4-tert-amylcyclohexyl)amino]-2-keto-ethyl]-3-nitro-benzamide Formula: C20H29N3O4 MolecularWeight: 375.46196

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(CC1)NC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C)C1CCC(CC1)NC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H29N3O4/c1-4-20(2,3)15-8-10-16(11-9-15)22-18(24)13-21-19(25)14-6-5-7-17(12-14)23(26)27/h5-7,12,15-16H,4,8-11,13H2,1-3H3,(H,21,25)(H,22,24)