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

Systemtic Name: 1-[(3-methoxyphenyl)-pyridin-3-yl-methyl]-1,4-diazepane Openeye Name: 1-[(3-methoxyphenyl)-(3-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(3-methoxyphenyl)-(3-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-methoxyphenyl)-pyridin-3-ylmethyl]-1,4-diazepane Traditional Name: 1-[(3-methoxyphenyl)-(3-pyridyl)methyl]-1,4-diazepane Formula: C18H23N3O MolecularWeight: 297.39472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C2=CN=CC=C2)N3CCCNCC3

Isomeric SMILES

COC1=CC=CC(=C1)C(C2=CN=CC=C2)N3CCCNCC3

InChI

InChI=1S/C18H23N3O/c1-22-17-7-2-5-15(13-17)18(16-6-3-8-20-14-16)21-11-4-9-19-10-12-21/h2-3,5-8,13-14,18-19H,4,9-12H2,1H3