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3-phenylpropyl 4-(hexadecylamino)-4-oxidanylidene-butanoate

Systemtic Name:	3-phenylpropyl 4-(hexadecylamino)-4-oxidanylidene-butanoate
Openeye Name:	3-phenylpropyl 4-(hexadecylamino)-4-oxo-butanoate
CAS Name:	4-(hexadecylamino)-4-oxobutanoic acid 3-phenylpropyl ester
IUPAC Name:	3-phenylpropyl 4-(hexadecylamino)-4-oxobutanoate
Traditional Name:	4-(cetylamino)-4-keto-butyric acid 3-phenylpropyl ester
Formula:	C₂₉H₄₉NO₃
MolecularWeight:	459.70426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)CCC(=O)OCCCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=O)CCC(=O)OCCCC1=CC=CC=C1

InChI

InChI=1S/C29H49NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-25-30-28(31)23-24-29(32)33-26-19-22-27-20-16-15-17-21-27/h15-17,20-21H,2-14,18-19,22-26H2,1H3,(H,30,31)

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