[1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 2-nitrobenzoate

Systemtic Name: [1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 2-nitrobenzoate Openeye Name: [2-(cycloheptylamino)-1-methyl-2-oxo-ethyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [1-(cycloheptylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cycloheptylamino)-1-oxopropan-2-yl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [2-(cycloheptylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H22N2O5 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1CCCCCC1)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H22N2O5/c1-12(16(20)18-13-8-4-2-3-5-9-13)24-17(21)14-10-6-7-11-15(14)19(22)23/h6-7,10-13H,2-5,8-9H2,1H3,(H,18,20)