ethyl N-[(S)-(4-nitrophenyl)-[(1R)-2-oxidanylidenecyclohexyl]methyl]carbamate

Systemtic Name: ethyl N-[(S)-(4-nitrophenyl)-[(1R)-2-oxidanylidenecyclohexyl]methyl]carbamate Openeye Name: ethyl N-[(S)-(4-nitrophenyl)-[(1R)-2-oxocyclohexyl]methyl]carbamate CAS Name: N-[(S)-(4-nitrophenyl)-[(1R)-2-oxocyclohexyl]methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[(S)-(4-nitrophenyl)-[(1R)-2-oxocyclohexyl]methyl]carbamate Traditional Name: N-[(S)-[(1R)-2-ketocyclohexyl]-(4-nitrophenyl)methyl]carbamic acid ethyl ester Formula: C16H20N2O5 MolecularWeight: 320.3404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(C1CCCCC1=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N[C@@H]([C@H]1CCCCC1=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O5/c1-2-23-16(20)17-15(13-5-3-4-6-14(13)19)11-7-9-12(10-8-11)18(21)22/h7-10,13,15H,2-6H2,1H3,(H,17,20)/t13-,15+/m0/s1