(4-chloranyl-2-methyl-phenyl)-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (4-chloranyl-2-methyl-phenyl)-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (4-chloro-2-methyl-phenyl)-[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (4-chloro-2-methylphenyl)-[4-(3-pyridinylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (4-chloro-2-methylphenyl)-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (4-chloro-2-methyl-phenyl)-[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]methanone Formula: C19H22ClN3O MolecularWeight: 343.85048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)C(=O)N2CCCN(CC2)CC3=CN=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)C(=O)N2CCCN(CC2)CC3=CN=CC=C3

InChI

InChI=1S/C19H22ClN3O/c1-15-12-17(20)5-6-18(15)19(24)23-9-3-8-22(10-11-23)14-16-4-2-7-21-13-16/h2,4-7,12-13H,3,8-11,14H2,1H3