(1-methoxy-1-oxidanylidene-butan-2-yl) 4-(hexadecylamino)benzoate

Systemtic Name: (1-methoxy-1-oxidanylidene-butan-2-yl) 4-(hexadecylamino)benzoate Openeye Name: 1-methoxycarbonylpropyl 4-(hexadecylamino)benzoate CAS Name: 4-(hexadecylamino)benzoic acid (1-methoxy-1-oxobutan-2-yl) ester IUPAC Name: (1-methoxy-1-oxobutan-2-yl) 4-(hexadecylamino)benzoate Traditional Name: 4-(cetylamino)benzoic acid 1-carbomethoxypropyl ester Formula: C28H47NO4 MolecularWeight: 461.67708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(CC)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(CC)C(=O)OC

InChI

InChI=1S/C28H47NO4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-23-29-25-21-19-24(20-22-25)27(30)33-26(5-2)28(31)32-3/h19-22,26,29H,4-18,23H2,1-3H3