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

Systemtic Name: butyl-[(1R)-2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: butyl-[(1R)-2-(4-chloro-3-nitro-anilino)-2-oxo-1-phenyl-ethyl]ammonium CAS Name: butyl-[(1R)-2-(4-chloro-3-nitroanilino)-2-oxo-1-phenylethyl]ammonium IUPAC Name: butyl-[(1R)-2-(4-chloro-3-nitroanilino)-2-oxo-1-phenylethyl]azanium Traditional Name: butyl-[(1R)-2-(4-chloro-3-nitro-anilino)-2-keto-1-phenyl-ethyl]ammonium Formula: C18H21ClN3O3+ MolecularWeight: 362.83064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O3/c1-2-3-11-20-17(13-7-5-4-6-8-13)18(23)21-14-9-10-15(19)16(12-14)22(24)25/h4-10,12,17,20H,2-3,11H2,1H3,(H,21,23)/p+1/t17-/m1/s1