1-[(5-chloranyl-2-methoxy-phenyl)-(5-ethylpyridin-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-chloranyl-2-methoxy-phenyl)-(5-ethylpyridin-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(5-chloro-2-methoxy-phenyl)-(5-ethyl-2-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(5-chloro-2-methoxyphenyl)-(5-ethyl-2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-chloro-2-methoxyphenyl)-(5-ethylpyridin-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(5-chloro-2-methoxy-phenyl)-(5-ethyl-2-pyridyl)methyl]-1,4-diazepane Formula: C20H26ClN3O MolecularWeight: 359.89294

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)C(C2=C(C=CC(=C2)Cl)OC)N3CCCNCC3

Isomeric SMILES

CCC1=CN=C(C=C1)C(C2=C(C=CC(=C2)Cl)OC)N3CCCNCC3

InChI

InChI=1S/C20H26ClN3O/c1-3-15-5-7-18(23-14-15)20(24-11-4-9-22-10-12-24)17-13-16(21)6-8-19(17)25-2/h5-8,13-14,20,22H,3-4,9-12H2,1-2H3