methyl 4-(4-heptoxy-3-methoxy-phenyl)-2-(methoxycarbonylamino)-2-methyl-butanoate

Systemtic Name: methyl 4-(4-heptoxy-3-methoxy-phenyl)-2-(methoxycarbonylamino)-2-methyl-butanoate Openeye Name: methyl 4-(4-heptoxy-3-methoxy-phenyl)-2-(methoxycarbonylamino)-2-methyl-butanoate CAS Name: 4-(4-heptoxy-3-methoxyphenyl)-2-(methoxycarbonylamino)-2-methylbutanoic acid methyl ester IUPAC Name: methyl 4-(4-heptoxy-3-methoxyphenyl)-2-(methoxycarbonylamino)-2-methylbutanoate Traditional Name: 2-(carbomethoxyamino)-4-(4-heptoxy-3-methoxy-phenyl)-2-methyl-butyric acid methyl ester Formula: C22H35NO6 MolecularWeight: 409.5164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H35NO6/c1-6-7-8-9-10-15-29-18-12-11-17(16-19(18)26-3)13-14-22(2,20(24)27-4)23-21(25)28-5/h11-12,16H,6-10,13-15H2,1-5H3,(H,23,25)