4-(4-chloranyl-2-methyl-phenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one Openeye Name: 4-(4-chloro-2-methyl-phenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one CAS Name: 4-(4-chloro-2-methylphenoxy)-1-(4-methyl-1,4-diazepan-1-yl)-1-butanone IUPAC Name: 4-(4-chloro-2-methylphenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one Traditional Name: 4-(4-chloro-2-methyl-phenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one Formula: C17H25ClN2O2 MolecularWeight: 324.8456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)N2CCCN(CC2)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)N2CCCN(CC2)C

InChI

InChI=1S/C17H25ClN2O2/c1-14-13-15(18)6-7-16(14)22-12-3-5-17(21)20-9-4-8-19(2)10-11-20/h6-7,13H,3-5,8-12H2,1-2H3