1-[(4-ethoxy-3-methoxy-phenyl)-pyridin-2-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(4-ethoxy-3-methoxy-phenyl)-pyridin-2-yl-methyl]-1,4-diazepane Openeye Name: 1-[(4-ethoxy-3-methoxy-phenyl)-(2-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(4-ethoxy-3-methoxyphenyl)-(2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-ethoxy-3-methoxyphenyl)-pyridin-2-ylmethyl]-1,4-diazepane Traditional Name: 1-[(4-ethoxy-3-methoxy-phenyl)-(2-pyridyl)methyl]-1,4-diazepane Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=CC=CC=N2)N3CCCNCC3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=CC=CC=N2)N3CCCNCC3)OC

InChI

InChI=1S/C20H27N3O2/c1-3-25-18-9-8-16(15-19(18)24-2)20(17-7-4-5-11-22-17)23-13-6-10-21-12-14-23/h4-5,7-9,11,15,20-21H,3,6,10,12-14H2,1-2H3