1-octadecyl-3-(2-phenylethanoylamino)urea

Systemtic Name: 1-octadecyl-3-(2-phenylethanoylamino)urea Openeye Name: 1-octadecyl-3-[(2-phenylacetyl)amino]urea CAS Name: 1-octadecyl-3-[(1-oxo-2-phenylethyl)amino]urea IUPAC Name: 1-octadecyl-3-[(2-phenylacetyl)amino]urea Traditional Name: 1-[(2-phenylacetyl)amino]-3-stearyl-urea Formula: C27H47N3O2 MolecularWeight: 445.68098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)NNC(=O)CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)NNC(=O)CC1=CC=CC=C1

InChI

InChI=1S/C27H47N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-28-27(32)30-29-26(31)24-25-21-18-17-19-22-25/h17-19,21-22H,2-16,20,23-24H2,1H3,(H,29,31)(H2,28,30,32)