(phenylmethyl) 4-benzamido-5-(dodecylamino)-5-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) 4-benzamido-5-(dodecylamino)-5-oxidanylidene-pentanoate Openeye Name: benzyl 4-benzamido-5-(dodecylamino)-5-oxo-pentanoate CAS Name: 4-benzamido-5-(dodecylamino)-5-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-benzamido-5-(dodecylamino)-5-oxopentanoate Traditional Name: 4-benzamido-5-keto-5-(laurylamino)valeric acid benzyl ester Formula: C31H44N2O4 MolecularWeight: 508.69206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=O)C(CCC(=O)OCC1=CC=CC=C1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCNC(=O)C(CCC(=O)OCC1=CC=CC=C1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C31H44N2O4/c1-2-3-4-5-6-7-8-9-10-17-24-32-31(36)28(33-30(35)27-20-15-12-16-21-27)22-23-29(34)37-25-26-18-13-11-14-19-26/h11-16,18-21,28H,2-10,17,22-25H2,1H3,(H,32,36)(H,33,35)