2-(4-chlorophenyl)ethyl-bis[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 2-(4-chlorophenyl)ethyl-bis[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 2-(4-chlorophenyl)ethyl-bis[2-(3,4-dimethylanilino)-2-oxo-ethyl]ammonium CAS Name: 2-(4-chlorophenyl)ethyl-bis[2-(3,4-dimethylanilino)-2-oxoethyl]ammonium IUPAC Name: 2-(4-chlorophenyl)ethyl-bis[2-(3,4-dimethylanilino)-2-oxoethyl]azanium Traditional Name: 2-(4-chlorophenyl)ethyl-bis[2-(3,4-dimethylanilino)-2-keto-ethyl]ammonium Formula: C28H33ClN3O2+ MolecularWeight: 479.03352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[NH+](CCC2=CC=C(C=C2)Cl)CC(=O)NC3=CC(=C(C=C3)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[NH+](CCC2=CC=C(C=C2)Cl)CC(=O)NC3=CC(=C(C=C3)C)C)C

InChI

InChI=1S/C28H32ClN3O2/c1-19-5-11-25(15-21(19)3)30-27(33)17-32(14-13-23-7-9-24(29)10-8-23)18-28(34)31-26-12-6-20(2)22(4)16-26/h5-12,15-16H,13-14,17-18H2,1-4H3,(H,30,33)(H,31,34)/p+1