ethyl 2-[4-heptyl-3-[[(2-methyl-6-propan-2-yl-phenyl)carbamoylamino]methyl]phenoxy]-2-methyl-propanoate

Systemtic Name: ethyl 2-[4-heptyl-3-[[(2-methyl-6-propan-2-yl-phenyl)carbamoylamino]methyl]phenoxy]-2-methyl-propanoate Openeye Name: ethyl 2-[4-heptyl-3-[[(2-isopropyl-6-methyl-phenyl)carbamoylamino]methyl]phenoxy]-2-methyl-propanoate CAS Name: 2-[4-heptyl-3-[[[(2-methyl-6-propan-2-ylanilino)-oxomethyl]amino]methyl]phenoxy]-2-methylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[4-heptyl-3-[[(2-methyl-6-propan-2-ylphenyl)carbamoylamino]methyl]phenoxy]-2-methylpropanoate Traditional Name: 2-[4-heptyl-3-[[(2-isopropyl-6-methyl-phenyl)carbamoylamino]methyl]phenoxy]-2-methyl-propionic acid ethyl ester Formula: C31H46N2O4 MolecularWeight: 510.70794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C=C(C=C1)OC(C)(C)C(=O)OCC)CNC(=O)NC2=C(C=CC=C2C(C)C)C

Isomeric SMILES

CCCCCCCC1=C(C=C(C=C1)OC(C)(C)C(=O)OCC)CNC(=O)NC2=C(C=CC=C2C(C)C)C

InChI

InChI=1S/C31H46N2O4/c1-8-10-11-12-13-16-24-18-19-26(37-31(6,7)29(34)36-9-2)20-25(24)21-32-30(35)33-28-23(5)15-14-17-27(28)22(3)4/h14-15,17-20,22H,8-13,16,21H2,1-7H3,(H2,32,33,35)