1-[3-naphthalen-2-ylpropanoyl-[(3S)-1-nitro-2-oxidanylidene-5-phenyl-pentan-3-yl]amino]-3-(phenylmethyl)urea

Systemtic Name: 1-[3-naphthalen-2-ylpropanoyl-[(3S)-1-nitro-2-oxidanylidene-5-phenyl-pentan-3-yl]amino]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[3-(2-naphthyl)propanoyl-[(1S)-3-nitro-2-oxo-1-phenethyl-propyl]amino]urea CAS Name: 1-[[3-(2-naphthalenyl)-1-oxopropyl]-[(3S)-1-nitro-2-oxo-5-phenylpentan-3-yl]amino]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[3-naphthalen-2-ylpropanoyl-[(3S)-1-nitro-2-oxo-5-phenylpentan-3-yl]amino]urea Traditional Name: 1-benzyl-3-[[(1S)-2-keto-3-nitro-1-phenethyl-propyl]-[3-(2-naphthyl)propanoyl]amino]urea Formula: C32H32N4O5 MolecularWeight: 552.62028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)C[N+](=O)[O-])N(C(=O)CCC2=CC3=CC=CC=C3C=C2)NC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC[C@@H](C(=O)C[N+](=O)[O-])N(C(=O)CCC2=CC3=CC=CC=C3C=C2)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C32H32N4O5/c37-30(23-35(40)41)29(19-16-24-9-3-1-4-10-24)36(34-32(39)33-22-26-11-5-2-6-12-26)31(38)20-17-25-15-18-27-13-7-8-14-28(27)21-25/h1-15,18,21,29H,16-17,19-20,22-23H2,(H2,33,34,39)/t29-/m0/s1