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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(C(C1)(C2=CC(=CC=C2)O)O)CCCC3=CC=CC=C3

Isomeric SMILES

CC(=O)N1CCCN(C(C1)(C2=CC(=CC=C2)O)O)CCCC3=CC=CC=C3

InChI

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