cyclopropyl-[2-[(2,3-dimethyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: cyclopropyl-[2-[(2,3-dimethyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: cyclopropyl-[2-(2,3-dimethyl-6-nitro-anilino)-2-oxo-ethyl]-[(4-isopropylphenyl)methyl]ammonium CAS Name: cyclopropyl-[2-(2,3-dimethyl-6-nitroanilino)-2-oxoethyl]-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: cyclopropyl-[2-(2,3-dimethyl-6-nitroanilino)-2-oxoethyl]-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: cyclopropyl-[2-(2,3-dimethyl-6-nitro-anilino)-2-keto-ethyl]-(4-isopropylbenzyl)ammonium Formula: C23H30N3O3+ MolecularWeight: 396.5026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)C[NH+](CC2=CC=C(C=C2)C(C)C)C3CC3)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)C[NH+](CC2=CC=C(C=C2)C(C)C)C3CC3)C

InChI

InChI=1S/C23H29N3O3/c1-15(2)19-8-6-18(7-9-19)13-25(20-10-11-20)14-22(27)24-23-17(4)16(3)5-12-21(23)26(28)29/h5-9,12,15,20H,10-11,13-14H2,1-4H3,(H,24,27)/p+1