1-[(3,5-dimethylphenyl)-(2-methoxyphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(3,5-dimethylphenyl)-(2-methoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(3,5-dimethylphenyl)-(2-methoxyphenyl)methyl]-1,4-diazepane CAS Name: 1-[(3,5-dimethylphenyl)-(2-methoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3,5-dimethylphenyl)-(2-methoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(3,5-dimethylphenyl)-(2-methoxyphenyl)methyl]-1,4-diazepane Formula: C21H28N2O MolecularWeight: 324.45982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(C2=CC=CC=C2OC)N3CCCNCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(C2=CC=CC=C2OC)N3CCCNCC3)C

InChI

InChI=1S/C21H28N2O/c1-16-13-17(2)15-18(14-16)21(23-11-6-9-22-10-12-23)19-7-4-5-8-20(19)24-3/h4-5,7-8,13-15,21-22H,6,9-12H2,1-3H3