1-[(3,5-dimethylphenyl)-pyridin-3-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(3,5-dimethylphenyl)-pyridin-3-yl-methyl]-1,4-diazepane Openeye Name: 1-[(3,5-dimethylphenyl)-(3-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(3,5-dimethylphenyl)-(3-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3,5-dimethylphenyl)-pyridin-3-ylmethyl]-1,4-diazepane Traditional Name: 1-[(3,5-dimethylphenyl)-(3-pyridyl)methyl]-1,4-diazepane Formula: C19H25N3 MolecularWeight: 295.4219

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3/c1-15-11-16(2)13-18(12-15)19(17-5-3-6-21-14-17)22-9-4-7-20-8-10-22/h3,5-6,11-14,19-20H,4,7-10H2,1-2H3