4-(cyclohexylcarbamoylamino)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]butanamide

Systemtic Name: 4-(cyclohexylcarbamoylamino)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]butanamide Openeye Name: 4-(cyclohexylcarbamoylamino)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]butanamide CAS Name: 4-[[(cyclohexylamino)-oxomethyl]amino]-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]butanamide IUPAC Name: 4-(cyclohexylcarbamoylamino)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]butanamide Traditional Name: 4-(cyclohexylcarbamoylamino)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]butyramide Formula: C21H32N4O6 MolecularWeight: 436.50198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)CCCNC(=O)NC2CCCCC2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)CCCNC(=O)NC2CCCCC2)[N+](=O)[O-])OC

InChI

InChI=1S/C21H32N4O6/c1-30-18-13-15(17(25(28)29)14-19(18)31-2)10-12-22-20(26)9-6-11-23-21(27)24-16-7-4-3-5-8-16/h13-14,16H,3-12H2,1-2H3,(H,22,26)(H2,23,24,27)