1-[(4-ethylphenyl)-pyridin-2-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(4-ethylphenyl)-pyridin-2-yl-methyl]-1,4-diazepane Openeye Name: 1-[(4-ethylphenyl)-(2-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(4-ethylphenyl)-(2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-ethylphenyl)-pyridin-2-ylmethyl]-1,4-diazepane Traditional Name: 1-[(4-ethylphenyl)-(2-pyridyl)methyl]-1,4-diazepane Formula: C19H25N3 MolecularWeight: 295.4219

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CC=N2)N3CCCNCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CC=N2)N3CCCNCC3

InChI

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