3-azanyl-4-cyclohexyl-N-(2-methoxy-5-nitro-phenyl)-2-oxidanyl-butanamide hydrochloride

Systemtic Name: 3-azanyl-4-cyclohexyl-N-(2-methoxy-5-nitro-phenyl)-2-oxidanyl-butanamide hydrochloride Openeye Name: 3-amino-4-cyclohexyl-2-hydroxy-N-(2-methoxy-5-nitro-phenyl)butanamide hydrochloride CAS Name: 3-amino-4-cyclohexyl-2-hydroxy-N-(2-methoxy-5-nitrophenyl)butanamide hydrochloride IUPAC Name: 3-amino-4-cyclohexyl-2-hydroxy-N-(2-methoxy-5-nitrophenyl)butanamide hydrochloride Traditional Name: 3-amino-4-cyclohexyl-2-hydroxy-N-(2-methoxy-5-nitro-phenyl)butyramide hydrochloride Formula: C17H26ClN3O5 MolecularWeight: 387.85844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C(CC2CCCCC2)N)O.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C(CC2CCCCC2)N)O.Cl

InChI

InChI=1S/C17H25N3O5.ClH/c1-25-15-8-7-12(20(23)24)10-14(15)19-17(22)16(21)13(18)9-11-5-3-2-4-6-11;/h7-8,10-11,13,16,21H,2-6,9,18H2,1H3,(H,19,22);1H