1-[(3-fluoranyl-4-methoxy-phenyl)-(3-methylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(3-fluoranyl-4-methoxy-phenyl)-(3-methylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(3-fluoro-4-methoxy-phenyl)-(m-tolyl)methyl]-1,4-diazepane CAS Name: 1-[(3-fluoro-4-methoxyphenyl)-(3-methylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-fluoro-4-methoxyphenyl)-(3-methylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(3-fluoro-4-methoxy-phenyl)-(m-tolyl)methyl]-1,4-diazepane Formula: C20H25FN2O MolecularWeight: 328.423703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC(=C(C=C2)OC)F)N3CCCNCC3

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC(=C(C=C2)OC)F)N3CCCNCC3

InChI

InChI=1S/C20H25FN2O/c1-15-5-3-6-16(13-15)20(23-11-4-9-22-10-12-23)17-7-8-19(24-2)18(21)14-17/h3,5-8,13-14,20,22H,4,9-12H2,1-2H3