3-[2-oxidanylidene-7-phenyl-3-(1-pyridin-4-ylethyl)-1,3-oxazepan-7-yl]propanamide

Systemtic Name: 3-[2-oxidanylidene-7-phenyl-3-(1-pyridin-4-ylethyl)-1,3-oxazepan-7-yl]propanamide Openeye Name: 3-[2-oxo-7-phenyl-3-[1-(4-pyridyl)ethyl]-1,3-oxazepan-7-yl]propanamide CAS Name: 3-[2-oxo-7-phenyl-3-(1-pyridin-4-ylethyl)-1,3-oxazepan-7-yl]propanamide IUPAC Name: 3-[2-oxo-7-phenyl-3-(1-pyridin-4-ylethyl)-1,3-oxazepan-7-yl]propanamide Traditional Name: 3-[2-keto-7-phenyl-3-[1-(4-pyridyl)ethyl]-1,3-oxazepan-7-yl]propionamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)N2CCCC(OC2=O)(CCC(=O)N)C3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=NC=C1)N2CCCC(OC2=O)(CCC(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O3/c1-16(17-9-13-23-14-10-17)24-15-5-11-21(27-20(24)26,12-8-19(22)25)18-6-3-2-4-7-18/h2-4,6-7,9-10,13-14,16H,5,8,11-12,15H2,1H3,(H2,22,25)