(3-fluoranyl-4-methyl-phenyl)-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (3-fluoranyl-4-methyl-phenyl)-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (3-fluoro-4-methyl-phenyl)-[4-(o-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (3-fluoro-4-methylphenyl)-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (3-fluoro-4-methylphenyl)-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (3-fluoro-4-methyl-phenyl)-[4-(2-methylbenzyl)-1,4-diazepan-1-yl]methanone Formula: C21H25FN2O MolecularWeight: 340.434403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC=CC=C3C)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC=CC=C3C)F

InChI

InChI=1S/C21H25FN2O/c1-16-6-3-4-7-19(16)15-23-10-5-11-24(13-12-23)21(25)18-9-8-17(2)20(22)14-18/h3-4,6-9,14H,5,10-13,15H2,1-2H3