(2-oxidanylidenecyclohexyl) 2-(butoxycarbonylamino)-3-phenyl-propanoate

Systemtic Name: (2-oxidanylidenecyclohexyl) 2-(butoxycarbonylamino)-3-phenyl-propanoate Openeye Name: (2-oxocyclohexyl) 2-(butoxycarbonylamino)-3-phenyl-propanoate CAS Name: 2-[[butoxy(oxo)methyl]amino]-3-phenylpropanoic acid (2-oxocyclohexyl) ester IUPAC Name: (2-oxocyclohexyl) 2-(butoxycarbonylamino)-3-phenylpropanoate Traditional Name: 2-(butoxycarbonylamino)-3-phenyl-propionic acid (2-ketocyclohexyl) ester Formula: C20H27NO5 MolecularWeight: 361.43208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC(CC1=CC=CC=C1)C(=O)OC2CCCCC2=O

Isomeric SMILES

CCCCOC(=O)NC(CC1=CC=CC=C1)C(=O)OC2CCCCC2=O

InChI

InChI=1S/C20H27NO5/c1-2-3-13-25-20(24)21-16(14-15-9-5-4-6-10-15)19(23)26-18-12-8-7-11-17(18)22/h4-6,9-10,16,18H,2-3,7-8,11-14H2,1H3,(H,21,24)