cyclopropyl-[(2-fluorophenyl)methyl]-[2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cyclopropyl-[(2-fluorophenyl)methyl]-[2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: cyclopropyl-[(2-fluorophenyl)methyl]-[2-(5-methoxy-2-methyl-4-nitro-anilino)-2-oxo-ethyl]ammonium CAS Name: cyclopropyl-[(2-fluorophenyl)methyl]-[2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: cyclopropyl-[(2-fluorophenyl)methyl]-[2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl]azanium Traditional Name: cyclopropyl-(2-fluorobenzyl)-[2-keto-2-(5-methoxy-2-methyl-4-nitro-anilino)ethyl]ammonium Formula: C20H23FN3O4+ MolecularWeight: 388.412723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C[NH+](CC2=CC=CC=C2F)C3CC3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C[NH+](CC2=CC=CC=C2F)C3CC3)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H22FN3O4/c1-13-9-18(24(26)27)19(28-2)10-17(13)22-20(25)12-23(15-7-8-15)11-14-5-3-4-6-16(14)21/h3-6,9-10,15H,7-8,11-12H2,1-2H3,(H,22,25)/p+1