[2-oxidanylidene-2-[(2-phenylazanylphenyl)amino]ethyl]-(phenylmethyl)-di(propan-2-yl)azanium

Systemtic Name: [2-oxidanylidene-2-[(2-phenylazanylphenyl)amino]ethyl]-(phenylmethyl)-di(propan-2-yl)azanium Openeye Name: [2-(2-anilinoanilino)-2-oxo-ethyl]-benzyl-diisopropyl-ammonium CAS Name: [2-(2-anilinoanilino)-2-oxoethyl]-(phenylmethyl)-di(propan-2-yl)ammonium IUPAC Name: [2-(2-anilinoanilino)-2-oxoethyl]-benzyl-di(propan-2-yl)azanium Traditional Name: [2-(2-anilinoanilino)-2-keto-ethyl]-benzyl-diisopropyl-ammonium Formula: C27H34N3O+ MolecularWeight: 416.57836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](CC1=CC=CC=C1)(CC(=O)NC2=CC=CC=C2NC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC(C)[N+](CC1=CC=CC=C1)(CC(=O)NC2=CC=CC=C2NC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C27H33N3O/c1-21(2)30(22(3)4,19-23-13-7-5-8-14-23)20-27(31)29-26-18-12-11-17-25(26)28-24-15-9-6-10-16-24/h5-18,21-22,28H,19-20H2,1-4H3/p+1