2-azanyl-3-(4-hydroxyphenyl)-1-[4-(2-phenylethanoyl)-1,4-diazepan-1-yl]propan-1-one

Systemtic Name: 2-azanyl-3-(4-hydroxyphenyl)-1-[4-(2-phenylethanoyl)-1,4-diazepan-1-yl]propan-1-one Openeye Name: 2-amino-3-(4-hydroxyphenyl)-1-[4-(2-phenylacetyl)-1,4-diazepan-1-yl]propan-1-one CAS Name: 2-amino-3-(4-hydroxyphenyl)-1-[4-(1-oxo-2-phenylethyl)-1,4-diazepan-1-yl]-1-propanone IUPAC Name: 2-amino-3-(4-hydroxyphenyl)-1-[4-(2-phenylacetyl)-1,4-diazepan-1-yl]propan-1-one Traditional Name: 2-amino-3-(4-hydroxyphenyl)-1-[4-(2-phenylacetyl)-1,4-diazepan-1-yl]propan-1-one Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C(CC2=CC=C(C=C2)O)N)C(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)C(CC2=CC=C(C=C2)O)N)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3/c23-20(15-18-7-9-19(26)10-8-18)22(28)25-12-4-11-24(13-14-25)21(27)16-17-5-2-1-3-6-17/h1-3,5-10,20,26H,4,11-16,23H2