N-[(2-chloranyl-5-nitro-phenyl)methyl]-4-(cyclohexylcarbamoylamino)-N-methyl-butanamide

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-4-(cyclohexylcarbamoylamino)-N-methyl-butanamide Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-4-(cyclohexylcarbamoylamino)-N-methyl-butanamide CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-4-[[(cyclohexylamino)-oxomethyl]amino]-N-methylbutanamide IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-4-(cyclohexylcarbamoylamino)-N-methylbutanamide Traditional Name: N-(2-chloro-5-nitro-benzyl)-4-(cyclohexylcarbamoylamino)-N-methyl-butyramide Formula: C19H27ClN4O4 MolecularWeight: 410.89508

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)CCCNC(=O)NC2CCCCC2

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)CCCNC(=O)NC2CCCCC2

InChI

InChI=1S/C19H27ClN4O4/c1-23(13-14-12-16(24(27)28)9-10-17(14)20)18(25)8-5-11-21-19(26)22-15-6-3-2-4-7-15/h9-10,12,15H,2-8,11,13H2,1H3,(H2,21,22,26)