ethyl 2-(4-hydroxyphenyl)-2-(2-oxidanylideneazepan-1-yl)ethanoate

Systemtic Name: ethyl 2-(4-hydroxyphenyl)-2-(2-oxidanylideneazepan-1-yl)ethanoate Openeye Name: ethyl 2-(4-hydroxyphenyl)-2-(2-oxoazepan-1-yl)acetate CAS Name: 2-(4-hydroxyphenyl)-2-(2-oxo-1-azepanyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(4-hydroxyphenyl)-2-(2-oxoazepan-1-yl)acetate Traditional Name: 2-(4-hydroxyphenyl)-2-(2-ketoazepan-1-yl)acetic acid ethyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=C(C=C1)O)N2CCCCCC2=O

Isomeric SMILES

CCOC(=O)C(C1=CC=C(C=C1)O)N2CCCCCC2=O

InChI

InChI=1S/C16H21NO4/c1-2-21-16(20)15(12-7-9-13(18)10-8-12)17-11-5-3-4-6-14(17)19/h7-10,15,18H,2-6,11H2,1H3