1-[(5-ethylpyridin-2-yl)-(2-methoxyphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-ethylpyridin-2-yl)-(2-methoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(5-ethyl-2-pyridyl)-(2-methoxyphenyl)methyl]-1,4-diazepane CAS Name: 1-[(5-ethyl-2-pyridinyl)-(2-methoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-ethylpyridin-2-yl)-(2-methoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-ethyl-2-pyridyl)-(2-methoxyphenyl)methyl]-1,4-diazepane Formula: C20H27N3O MolecularWeight: 325.44788

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)C(C2=CC=CC=C2OC)N3CCCNCC3

Isomeric SMILES

CCC1=CN=C(C=C1)C(C2=CC=CC=C2OC)N3CCCNCC3

InChI

InChI=1S/C20H27N3O/c1-3-16-9-10-18(22-15-16)20(23-13-6-11-21-12-14-23)17-7-4-5-8-19(17)24-2/h4-5,7-10,15,20-21H,3,6,11-14H2,1-2H3