3-methylbutyl 4-[(2,5-dimethoxyphenyl)methoxycarbonyl-ethyl-amino]benzoate

Systemtic Name: 3-methylbutyl 4-[(2,5-dimethoxyphenyl)methoxycarbonyl-ethyl-amino]benzoate Openeye Name: isopentyl 4-[(2,5-dimethoxyphenyl)methoxycarbonyl-ethyl-amino]benzoate CAS Name: 4-[[(2,5-dimethoxyphenyl)methoxy-oxomethyl]-ethylamino]benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-[(2,5-dimethoxyphenyl)methoxycarbonyl-ethylamino]benzoate Traditional Name: 4-[(2,5-dimethoxybenzyl)oxycarbonyl-ethyl-amino]benzoic acid isoamyl ester Formula: C24H31NO6 MolecularWeight: 429.50604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)C(=O)OCCC(C)C)C(=O)OCC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CCN(C1=CC=C(C=C1)C(=O)OCCC(C)C)C(=O)OCC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C24H31NO6/c1-6-25(20-9-7-18(8-10-20)23(26)30-14-13-17(2)3)24(27)31-16-19-15-21(28-4)11-12-22(19)29-5/h7-12,15,17H,6,13-14,16H2,1-5H3