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

Systemtic Name: N-[(2S)-4-methyl-1-[[(3S)-1-nitro-2-oxidanylidene-5-phenyl-pentan-3-yl]amino]-1-oxidanylidene-pentan-2-yl]-4-piperidin-1-yl-piperidine-1-carboxamide Openeye Name: N-[(1S)-3-methyl-1-[[(1S)-3-nitro-2-oxo-1-phenethyl-propyl]carbamoyl]butyl]-4-(1-piperidyl)piperidine-1-carboxamide CAS Name: N-[(2S)-4-methyl-1-[[(3S)-1-nitro-2-oxo-5-phenylpentan-3-yl]amino]-1-oxopentan-2-yl]-4-(1-piperidinyl)-1-piperidinecarboxamide IUPAC Name: N-[(2S)-4-methyl-1-[[(3S)-1-nitro-2-oxo-5-phenylpentan-3-yl]amino]-1-oxopentan-2-yl]-4-piperidin-1-ylpiperidine-1-carboxamide Traditional Name: N-[(1S)-1-[[(1S)-2-keto-3-nitro-1-phenethyl-propyl]carbamoyl]-3-methyl-butyl]-4-piperidino-piperidine-1-carboxamide Formula: C28H43N5O5 MolecularWeight: 529.67152

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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)N2CCC(CC2)N3CCCCC3

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CCC1=CC=CC=C1)C(=O)C[N+](=O)[O-])NC(=O)N2CCC(CC2)N3CCCCC3

InChI

InChI=1S/C28H43N5O5/c1-21(2)19-25(30-28(36)32-17-13-23(14-18-32)31-15-7-4-8-16-31)27(35)29-24(26(34)20-33(37)38)12-11-22-9-5-3-6-10-22/h3,5-6,9-10,21,23-25H,4,7-8,11-20H2,1-2H3,(H,29,35)(H,30,36)/t24-,25-/m0/s1