ethyl 2-[(3-cyclohexyl-3-oxidanyl-propyl)amino]-3-[3-(3-ethoxy-3-oxidanylidene-propyl)phenyl]propanoate

Systemtic Name: ethyl 2-[(3-cyclohexyl-3-oxidanyl-propyl)amino]-3-[3-(3-ethoxy-3-oxidanylidene-propyl)phenyl]propanoate Openeye Name: ethyl 2-[(3-cyclohexyl-3-hydroxy-propyl)amino]-3-[3-(3-ethoxy-3-oxo-propyl)phenyl]propanoate CAS Name: 2-[(3-cyclohexyl-3-hydroxypropyl)amino]-3-[3-(3-ethoxy-3-oxopropyl)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-[(3-cyclohexyl-3-hydroxypropyl)amino]-3-[3-(3-ethoxy-3-oxopropyl)phenyl]propanoate Traditional Name: 2-[(3-cyclohexyl-3-hydroxy-propyl)amino]-3-[3-(3-ethoxy-3-keto-propyl)phenyl]propionic acid ethyl ester Formula: C25H39NO5 MolecularWeight: 433.58086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC(=CC=C1)CC(C(=O)OCC)NCCC(C2CCCCC2)O

Isomeric SMILES

CCOC(=O)CCC1=CC(=CC=C1)CC(C(=O)OCC)NCCC(C2CCCCC2)O

InChI

InChI=1S/C25H39NO5/c1-3-30-24(28)14-13-19-9-8-10-20(17-19)18-22(25(29)31-4-2)26-16-15-23(27)21-11-6-5-7-12-21/h8-10,17,21-23,26-27H,3-7,11-16,18H2,1-2H3