octyl 2-[(2-octadecoxy-2-oxidanylidene-ethyl)carbamoylamino]-3-phenyl-propanoate

Systemtic Name: octyl 2-[(2-octadecoxy-2-oxidanylidene-ethyl)carbamoylamino]-3-phenyl-propanoate Openeye Name: octyl 2-[(2-octadecoxy-2-oxo-ethyl)carbamoylamino]-3-phenyl-propanoate CAS Name: 2-[[[(2-octadecoxy-2-oxoethyl)amino]-oxomethyl]amino]-3-phenylpropanoic acid octyl ester IUPAC Name: octyl 2-[(2-octadecoxy-2-oxoethyl)carbamoylamino]-3-phenylpropanoate Traditional Name: 2-[(2-keto-2-stearyloxy-ethyl)carbamoylamino]-3-phenyl-propionic acid octyl ester Formula: C38H66N2O5 MolecularWeight: 630.94104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)CNC(=O)NC(CC1=CC=CC=C1)C(=O)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CNC(=O)NC(CC1=CC=CC=C1)C(=O)OCCCCCCCC

InChI

InChI=1S/C38H66N2O5/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-22-26-30-44-36(41)33-39-38(43)40-35(32-34-28-24-23-25-29-34)37(42)45-31-27-21-10-8-6-4-2/h23-25,28-29,35H,3-22,26-27,30-33H2,1-2H3,(H2,39,40,43)