3-(3-chlorophenyl)-3-(3-hydroxyphenyl)-1-(4-methyl-1,4-diazepan-1-yl)propan-1-one

Systemtic Name: 3-(3-chlorophenyl)-3-(3-hydroxyphenyl)-1-(4-methyl-1,4-diazepan-1-yl)propan-1-one Openeye Name: 3-(3-chlorophenyl)-3-(3-hydroxyphenyl)-1-(4-methyl-1,4-diazepan-1-yl)propan-1-one CAS Name: 3-(3-chlorophenyl)-3-(3-hydroxyphenyl)-1-(4-methyl-1,4-diazepan-1-yl)-1-propanone IUPAC Name: 3-(3-chlorophenyl)-3-(3-hydroxyphenyl)-1-(4-methyl-1,4-diazepan-1-yl)propan-1-one Traditional Name: 3-(3-chlorophenyl)-3-(3-hydroxyphenyl)-1-(4-methyl-1,4-diazepan-1-yl)propan-1-one Formula: C21H25ClN2O2 MolecularWeight: 372.8884

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=O)CC(C2=CC(=CC=C2)O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CN1CCCN(CC1)C(=O)CC(C2=CC(=CC=C2)O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H25ClN2O2/c1-23-9-4-10-24(12-11-23)21(26)15-20(16-5-2-7-18(22)13-16)17-6-3-8-19(25)14-17/h2-3,5-8,13-14,20,25H,4,9-12,15H2,1H3