1-[4-[3-(3-hydroxyphenyl)-3-oxidanyl-3-phenyl-propyl]-1,4-diazepan-1-yl]ethanone

Systemtic Name: 1-[4-[3-(3-hydroxyphenyl)-3-oxidanyl-3-phenyl-propyl]-1,4-diazepan-1-yl]ethanone Openeye Name: 1-[4-[3-hydroxy-3-(3-hydroxyphenyl)-3-phenyl-propyl]-1,4-diazepan-1-yl]ethanone CAS Name: 1-[4-[3-hydroxy-3-(3-hydroxyphenyl)-3-phenylpropyl]-1,4-diazepan-1-yl]ethanone IUPAC Name: 1-[4-[3-hydroxy-3-(3-hydroxyphenyl)-3-phenylpropyl]-1,4-diazepan-1-yl]ethanone Traditional Name: 1-[4-[3-hydroxy-3-(3-hydroxyphenyl)-3-phenyl-propyl]-1,4-diazepan-1-yl]ethanone Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)CCC(C2=CC=CC=C2)(C3=CC(=CC=C3)O)O

Isomeric SMILES

CC(=O)N1CCCN(CC1)CCC(C2=CC=CC=C2)(C3=CC(=CC=C3)O)O

InChI

InChI=1S/C22H28N2O3/c1-18(25)24-13-6-12-23(15-16-24)14-11-22(27,19-7-3-2-4-8-19)20-9-5-10-21(26)17-20/h2-5,7-10,17,26-27H,6,11-16H2,1H3