[(1R)-2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(3-oxidanylpropyl)azanium

Systemtic Name: [(1R)-2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(3-oxidanylpropyl)azanium Openeye Name: [(1R)-2-(4-chloro-3-nitro-anilino)-2-oxo-1-phenyl-ethyl]-(3-hydroxypropyl)ammonium CAS Name: [(1R)-2-(4-chloro-3-nitroanilino)-2-oxo-1-phenylethyl]-(3-hydroxypropyl)ammonium IUPAC Name: [(1R)-2-(4-chloro-3-nitroanilino)-2-oxo-1-phenylethyl]-(3-hydroxypropyl)azanium Traditional Name: [(1R)-2-(4-chloro-3-nitro-anilino)-2-keto-1-phenyl-ethyl]-(3-hydroxypropyl)ammonium Formula: C17H19ClN3O4+ MolecularWeight: 364.80346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])[NH2+]CCCO

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])[NH2+]CCCO

InChI

InChI=1S/C17H18ClN3O4/c18-14-8-7-13(11-15(14)21(24)25)20-17(23)16(19-9-4-10-22)12-5-2-1-3-6-12/h1-3,5-8,11,16,19,22H,4,9-10H2,(H,20,23)/p+1/t16-/m1/s1