N-[(2S)-1-[2-(4-chlorophenyl)ethylamino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(2S)-1-[2-(4-chlorophenyl)ethylamino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: N-[(1S)-2-[2-(4-chlorophenyl)ethylamino]-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[(2S)-1-[2-(4-chlorophenyl)ethylamino]-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: N-[(2S)-1-[2-(4-chlorophenyl)ethylamino]-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: N-[(1S)-2-[2-(4-chlorophenyl)ethylamino]-2-keto-1-methyl-ethyl]-3-nitro-benzamide Formula: C18H18ClN3O4 MolecularWeight: 375.80622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=C(C=C1)Cl)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NCCC1=CC=C(C=C1)Cl)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18ClN3O4/c1-12(17(23)20-10-9-13-5-7-15(19)8-6-13)21-18(24)14-3-2-4-16(11-14)22(25)26/h2-8,11-12H,9-10H2,1H3,(H,20,23)(H,21,24)/t12-/m0/s1