cyclopropyl-[(4-methoxyphenyl)methyl]-[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(1R)-1-methyl-2-(2-nitroanilino)-2-oxo-ethyl]ammonium CAS Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl]ammonium IUPAC Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl]azanium Traditional Name: cyclopropyl-[(1R)-2-keto-1-methyl-2-(2-nitroanilino)ethyl]-p-anisyl-ammonium Formula: C20H24N3O4+ MolecularWeight: 370.42226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])[NH+](CC2=CC=C(C=C2)OC)C3CC3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1[N+](=O)[O-])[NH+](CC2=CC=C(C=C2)OC)C3CC3

InChI

InChI=1S/C20H23N3O4/c1-14(20(24)21-18-5-3-4-6-19(18)23(25)26)22(16-9-10-16)13-15-7-11-17(27-2)12-8-15/h3-8,11-12,14,16H,9-10,13H2,1-2H3,(H,21,24)/p+1/t14-/m1/s1