ethyl 2-(cyclopropylmethyl)-4-(4-heptoxyphenyl)-2-(methoxycarbonylamino)butanoate

Systemtic Name: ethyl 2-(cyclopropylmethyl)-4-(4-heptoxyphenyl)-2-(methoxycarbonylamino)butanoate Openeye Name: ethyl 2-(cyclopropylmethyl)-4-(4-heptoxyphenyl)-2-(methoxycarbonylamino)butanoate CAS Name: 2-(cyclopropylmethyl)-4-(4-heptoxyphenyl)-2-(methoxycarbonylamino)butanoic acid ethyl ester IUPAC Name: ethyl 2-(cyclopropylmethyl)-4-(4-heptoxyphenyl)-2-(methoxycarbonylamino)butanoate Traditional Name: 2-(carbomethoxyamino)-2-(cyclopropylmethyl)-4-(4-heptoxyphenyl)butyric acid ethyl ester Formula: C25H39NO5 MolecularWeight: 433.58086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)CCC(CC2CC2)(C(=O)OCC)NC(=O)OC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)CCC(CC2CC2)(C(=O)OCC)NC(=O)OC

InChI

InChI=1S/C25H39NO5/c1-4-6-7-8-9-18-31-22-14-12-20(13-15-22)16-17-25(19-21-10-11-21,23(27)30-5-2)26-24(28)29-3/h12-15,21H,4-11,16-19H2,1-3H3,(H,26,28)