4-tert-butyl-N-(2-methylquinolin-1-ium-8-yl)benzamide

Systemtic Name: 4-tert-butyl-N-(2-methylquinolin-1-ium-8-yl)benzamide Openeye Name: 4-tert-butyl-N-(2-methylquinolin-1-ium-8-yl)benzamide CAS Name: 4-tert-butyl-N-(2-methyl-8-quinolin-1-iumyl)benzamide IUPAC Name: 4-tert-butyl-N-(2-methylquinolin-1-ium-8-yl)benzamide Traditional Name: 4-tert-butyl-N-(2-methylquinolin-1-ium-8-yl)benzamide Formula: C21H23N2O+ MolecularWeight: 319.42012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=C(C=CC=C2NC(=O)C3=CC=C(C=C3)C(C)(C)C)C=C1

Isomeric SMILES

CC1=[NH+]C2=C(C=CC=C2NC(=O)C3=CC=C(C=C3)C(C)(C)C)C=C1

InChI

InChI=1S/C21H22N2O/c1-14-8-9-15-6-5-7-18(19(15)22-14)23-20(24)16-10-12-17(13-11-16)21(2,3)4/h5-13H,1-4H3,(H,23,24)/p+1