bis[2-[(2-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-cycloheptyl-azanium

Systemtic Name: bis[2-[(2-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-cycloheptyl-azanium Openeye Name: bis[2-(2-chloro-4-methyl-anilino)-2-oxo-ethyl]-cycloheptyl-ammonium CAS Name: bis[2-(2-chloro-4-methylanilino)-2-oxoethyl]-cycloheptylammonium IUPAC Name: bis[2-(2-chloro-4-methylanilino)-2-oxoethyl]-cycloheptylazanium Traditional Name: bis[2-(2-chloro-4-methyl-anilino)-2-keto-ethyl]-cycloheptyl-ammonium Formula: C25H32Cl2N3O2+ MolecularWeight: 477.44648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C[NH+](CC(=O)NC2=C(C=C(C=C2)C)Cl)C3CCCCCC3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C[NH+](CC(=O)NC2=C(C=C(C=C2)C)Cl)C3CCCCCC3)Cl

InChI

InChI=1S/C25H31Cl2N3O2/c1-17-9-11-22(20(26)13-17)28-24(31)15-30(19-7-5-3-4-6-8-19)16-25(32)29-23-12-10-18(2)14-21(23)27/h9-14,19H,3-8,15-16H2,1-2H3,(H,28,31)(H,29,32)/p+1