N-[(2S)-4-methyl-1-[[(3S)-1-nitro-2-oxidanylidene-5-phenyl-pentan-3-yl]amino]-1-oxidanylidene-pentan-2-yl]piperidine-4-carboxamide

Systemtic Name: N-[(2S)-4-methyl-1-[[(3S)-1-nitro-2-oxidanylidene-5-phenyl-pentan-3-yl]amino]-1-oxidanylidene-pentan-2-yl]piperidine-4-carboxamide Openeye Name: N-[(1S)-3-methyl-1-[[(1S)-3-nitro-2-oxo-1-phenethyl-propyl]carbamoyl]butyl]piperidine-4-carboxamide CAS Name: N-[(2S)-4-methyl-1-[[(3S)-1-nitro-2-oxo-5-phenylpentan-3-yl]amino]-1-oxopentan-2-yl]-4-piperidinecarboxamide IUPAC Name: N-[(2S)-4-methyl-1-[[(3S)-1-nitro-2-oxo-5-phenylpentan-3-yl]amino]-1-oxopentan-2-yl]piperidine-4-carboxamide Traditional Name: N-[(1S)-1-[[(1S)-2-keto-3-nitro-1-phenethyl-propyl]carbamoyl]-3-methyl-butyl]isonipecotamide Formula: C23H34N4O5 MolecularWeight: 446.53986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CCC1=CC=CC=C1)C(=O)C[N+](=O)[O-])NC(=O)C2CCNCC2

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CCC1=CC=CC=C1)C(=O)C[N+](=O)[O-])NC(=O)C2CCNCC2

InChI

InChI=1S/C23H34N4O5/c1-16(2)14-20(26-22(29)18-10-12-24-13-11-18)23(30)25-19(21(28)15-27(31)32)9-8-17-6-4-3-5-7-17/h3-7,16,18-20,24H,8-15H2,1-2H3,(H,25,30)(H,26,29)/t19-,20-/m0/s1