ethyl 2-[4-[[heptyl-[(2-methylphenyl)carbamoyl]amino]methyl]phenoxy]-2-methyl-propanoate

Systemtic Name: ethyl 2-[4-[[heptyl-[(2-methylphenyl)carbamoyl]amino]methyl]phenoxy]-2-methyl-propanoate Openeye Name: ethyl 2-[4-[[heptyl(o-tolylcarbamoyl)amino]methyl]phenoxy]-2-methyl-propanoate CAS Name: 2-[4-[[heptyl-[(2-methylanilino)-oxomethyl]amino]methyl]phenoxy]-2-methylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[4-[[heptyl-[(2-methylphenyl)carbamoyl]amino]methyl]phenoxy]-2-methylpropanoate Traditional Name: 2-[4-[[heptyl(o-tolylcarbamoyl)amino]methyl]phenoxy]-2-methyl-propionic acid ethyl ester Formula: C28H40N2O4 MolecularWeight: 468.6282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CC1=CC=C(C=C1)OC(C)(C)C(=O)OCC)C(=O)NC2=CC=CC=C2C

Isomeric SMILES

CCCCCCCN(CC1=CC=C(C=C1)OC(C)(C)C(=O)OCC)C(=O)NC2=CC=CC=C2C

InChI

InChI=1S/C28H40N2O4/c1-6-8-9-10-13-20-30(27(32)29-25-15-12-11-14-22(25)3)21-23-16-18-24(19-17-23)34-28(4,5)26(31)33-7-2/h11-12,14-19H,6-10,13,20-21H2,1-5H3,(H,29,32)