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

Systemtic Name: (4-chloranyl-2-methyl-phenyl)-[4-(pyridin-4-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (4-chloro-2-methyl-phenyl)-[4-(4-pyridylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (4-chloro-2-methylphenyl)-[4-(pyridin-4-ylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (4-chloro-2-methylphenyl)-[4-(pyridin-4-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (4-chloro-2-methyl-phenyl)-[4-(4-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=CC=NC=C3

Isomeric SMILES

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

InChI

InChI=1S/C19H22ClN3O/c1-15-13-17(20)3-4-18(15)19(24)23-10-2-9-22(11-12-23)14-16-5-7-21-8-6-16/h3-8,13H,2,9-12,14H2,1H3