N-(4-azanyl-2-methyl-quinolin-6-yl)-2-(4-phenoxybutyl)benzamide

Systemtic Name: N-(4-azanyl-2-methyl-quinolin-6-yl)-2-(4-phenoxybutyl)benzamide Openeye Name: N-(4-amino-2-methyl-6-quinolyl)-2-(4-phenoxybutyl)benzamide CAS Name: N-(4-amino-2-methyl-6-quinolinyl)-2-(4-phenoxybutyl)benzamide IUPAC Name: N-(4-amino-2-methylquinolin-6-yl)-2-(4-phenoxybutyl)benzamide Traditional Name: N-(4-amino-2-methyl-6-quinolyl)-2-(4-phenoxybutyl)benzamide Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3CCCCOC4=CC=CC=C4)C(=C1)N

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3CCCCOC4=CC=CC=C4)C(=C1)N

InChI

InChI=1S/C27H27N3O2/c1-19-17-25(28)24-18-21(14-15-26(24)29-19)30-27(31)23-13-6-5-9-20(23)10-7-8-16-32-22-11-3-2-4-12-22/h2-6,9,11-15,17-18H,7-8,10,16H2,1H3,(H2,28,29)(H,30,31)