ethyl 2-[2-(4-heptoxyphenyl)ethyl]-2-(methoxycarbonylamino)-3-methyl-butanoate

Systemtic Name: ethyl 2-[2-(4-heptoxyphenyl)ethyl]-2-(methoxycarbonylamino)-3-methyl-butanoate Openeye Name: ethyl 2-[2-(4-heptoxyphenyl)ethyl]-2-(methoxycarbonylamino)-3-methyl-butanoate CAS Name: 2-[2-(4-heptoxyphenyl)ethyl]-2-(methoxycarbonylamino)-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-heptoxyphenyl)ethyl]-2-(methoxycarbonylamino)-3-methylbutanoate Traditional Name: 2-(carbomethoxyamino)-2-[2-(4-heptoxyphenyl)ethyl]-3-methyl-butyric acid ethyl ester Formula: C24H39NO5 MolecularWeight: 421.57016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H39NO5/c1-6-8-9-10-11-18-30-21-14-12-20(13-15-21)16-17-24(19(3)4,22(26)29-7-2)25-23(27)28-5/h12-15,19H,6-11,16-18H2,1-5H3,(H,25,27)