2-[(1-cyclohexyl-3-nitro-5-oxidanylidene-2H-pyrrol-4-yl)amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(1-cyclohexyl-3-nitro-5-oxidanylidene-2H-pyrrol-4-yl)amino]-3-phenyl-propanoic acid Openeye Name: 2-[(1-cyclohexyl-3-nitro-5-oxo-2H-pyrrol-4-yl)amino]-3-phenyl-propanoic acid CAS Name: 2-[(1-cyclohexyl-3-nitro-5-oxo-2H-pyrrol-4-yl)amino]-3-phenylpropanoic acid IUPAC Name: 2-[(1-cyclohexyl-3-nitro-5-oxo-2H-pyrrol-4-yl)amino]-3-phenylpropanoic acid Traditional Name: 2-[(1-cyclohexyl-2-keto-4-nitro-3-pyrrolin-3-yl)amino]-3-phenyl-propionic acid Formula: C19H23N3O5 MolecularWeight: 373.40302

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(=C(C2=O)NC(CC3=CC=CC=C3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2CC(=C(C2=O)NC(CC3=CC=CC=C3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O5/c23-18-17(20-15(19(24)25)11-13-7-3-1-4-8-13)16(22(26)27)12-21(18)14-9-5-2-6-10-14/h1,3-4,7-8,14-15,20H,2,5-6,9-12H2,(H,24,25)