1-[(3S)-3-(3-chlorophenyl)-3-(3-hydroxyphenyl)propanoyl]-1,4-diazepan-5-one

Systemtic Name: 1-[(3S)-3-(3-chlorophenyl)-3-(3-hydroxyphenyl)propanoyl]-1,4-diazepan-5-one Openeye Name: 1-[(3S)-3-(3-chlorophenyl)-3-(3-hydroxyphenyl)propanoyl]-1,4-diazepan-5-one CAS Name: 1-[(3S)-3-(3-chlorophenyl)-3-(3-hydroxyphenyl)-1-oxopropyl]-1,4-diazepan-5-one IUPAC Name: 1-[(3S)-3-(3-chlorophenyl)-3-(3-hydroxyphenyl)propanoyl]-1,4-diazepan-5-one Traditional Name: 1-[(3S)-3-(3-chlorophenyl)-3-(3-hydroxyphenyl)propanoyl]-1,4-diazepan-5-one Formula: C20H21ClN2O3 MolecularWeight: 372.84534

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCNC1=O)C(=O)CC(C2=CC(=CC=C2)O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CCNC1=O)C(=O)C[C@@H](C2=CC(=CC=C2)O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H21ClN2O3/c21-16-5-1-3-14(11-16)18(15-4-2-6-17(24)12-15)13-20(26)23-9-7-19(25)22-8-10-23/h1-6,11-12,18,24H,7-10,13H2,(H,22,25)/t18-/m1/s1