cycloheptyl-bis[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cycloheptyl-bis[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: cycloheptyl-bis[2-(2,6-dimethylanilino)-2-oxo-ethyl]ammonium CAS Name: cycloheptyl-bis[2-(2,6-dimethylanilino)-2-oxoethyl]ammonium IUPAC Name: cycloheptyl-bis[2-(2,6-dimethylanilino)-2-oxoethyl]azanium Traditional Name: cycloheptyl-bis[2-(2,6-dimethylanilino)-2-keto-ethyl]ammonium Formula: C27H38N3O2+ MolecularWeight: 436.60952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+](CC(=O)NC2=C(C=CC=C2C)C)C3CCCCCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+](CC(=O)NC2=C(C=CC=C2C)C)C3CCCCCC3

InChI

InChI=1S/C27H37N3O2/c1-19-11-9-12-20(2)26(19)28-24(31)17-30(23-15-7-5-6-8-16-23)18-25(32)29-27-21(3)13-10-14-22(27)4/h9-14,23H,5-8,15-18H2,1-4H3,(H,28,31)(H,29,32)/p+1