(phenylmethyl) N-(2-naphthalen-2-ylethyl)-N-[[(3S)-1-nitro-2-oxidanylidene-5-phenyl-pentan-3-yl]carbamoyl]carbamate

Systemtic Name: (phenylmethyl) N-(2-naphthalen-2-ylethyl)-N-[[(3S)-1-nitro-2-oxidanylidene-5-phenyl-pentan-3-yl]carbamoyl]carbamate Openeye Name: benzyl N-[2-(2-naphthyl)ethyl]-N-[[(1S)-3-nitro-2-oxo-1-phenethyl-propyl]carbamoyl]carbamate CAS Name: N-[2-(2-naphthalenyl)ethyl]-N-[[[(3S)-1-nitro-2-oxo-5-phenylpentan-3-yl]amino]-oxomethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(2-naphthalen-2-ylethyl)-N-[[(3S)-1-nitro-2-oxo-5-phenylpentan-3-yl]carbamoyl]carbamate Traditional Name: N-[[(1S)-2-keto-3-nitro-1-phenethyl-propyl]carbamoyl]-N-[2-(2-naphthyl)ethyl]carbamic acid benzyl ester Formula: C32H31N3O6 MolecularWeight: 553.60504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)C[N+](=O)[O-])NC(=O)N(CCC2=CC3=CC=CC=C3C=C2)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC[C@@H](C(=O)C[N+](=O)[O-])NC(=O)N(CCC2=CC3=CC=CC=C3C=C2)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C32H31N3O6/c36-30(22-35(39)40)29(18-16-24-9-3-1-4-10-24)33-31(37)34(32(38)41-23-26-11-5-2-6-12-26)20-19-25-15-17-27-13-7-8-14-28(27)21-25/h1-15,17,21,29H,16,18-20,22-23H2,(H,33,37)/t29-/m0/s1