methyl 2-(heptylcarbamoylamino)-3-phenyl-propanoate

Systemtic Name: methyl 2-(heptylcarbamoylamino)-3-phenyl-propanoate Openeye Name: methyl 2-(heptylcarbamoylamino)-3-phenyl-propanoate CAS Name: 2-[[(heptylamino)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-(heptylcarbamoylamino)-3-phenylpropanoate Traditional Name: 2-(heptylcarbamoylamino)-3-phenyl-propionic acid methyl ester Formula: C18H28N2O3 MolecularWeight: 320.42652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)NC(CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCCCCCCNC(=O)NC(CC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C18H28N2O3/c1-3-4-5-6-10-13-19-18(22)20-16(17(21)23-2)14-15-11-8-7-9-12-15/h7-9,11-12,16H,3-6,10,13-14H2,1-2H3,(H2,19,20,22)