1-pyridin-3-yl-2-(3,4,5-trimethoxyphenyl)-1,4-diazepane

Systemtic Name: 1-pyridin-3-yl-2-(3,4,5-trimethoxyphenyl)-1,4-diazepane Openeye Name: 1-(3-pyridyl)-2-(3,4,5-trimethoxyphenyl)-1,4-diazepane CAS Name: 1-(3-pyridinyl)-2-(3,4,5-trimethoxyphenyl)-1,4-diazepane IUPAC Name: 1-pyridin-3-yl-2-(3,4,5-trimethoxyphenyl)-1,4-diazepane Traditional Name: 1-(3-pyridyl)-2-(3,4,5-trimethoxyphenyl)-1,4-diazepane Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2CNCCCN2C3=CN=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2CNCCCN2C3=CN=CC=C3

InChI

InChI=1S/C19H25N3O3/c1-23-17-10-14(11-18(24-2)19(17)25-3)16-13-21-8-5-9-22(16)15-6-4-7-20-12-15/h4,6-7,10-12,16,21H,5,8-9,13H2,1-3H3