hexadecyl 3-[[2,6-di(propan-2-yl)phenyl]amino]-3-oxidanylidene-2-phenyl-propanoate

Systemtic Name: hexadecyl 3-[[2,6-di(propan-2-yl)phenyl]amino]-3-oxidanylidene-2-phenyl-propanoate Openeye Name: hexadecyl 3-(2,6-diisopropylanilino)-3-oxo-2-phenyl-propanoate CAS Name: 3-[2,6-di(propan-2-yl)anilino]-3-oxo-2-phenylpropanoic acid hexadecyl ester IUPAC Name: hexadecyl 3-[2,6-di(propan-2-yl)anilino]-3-oxo-2-phenylpropanoate Traditional Name: 3-(2,6-diisopropylanilino)-3-keto-2-phenyl-propionic acid cetyl ester Formula: C37H57NO3 MolecularWeight: 563.85338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C(C1=CC=CC=C1)C(=O)NC2=C(C=CC=C2C(C)C)C(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C(C1=CC=CC=C1)C(=O)NC2=C(C=CC=C2C(C)C)C(C)C

InChI

InChI=1S/C37H57NO3/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-22-28-41-37(40)34(31-24-20-19-21-25-31)36(39)38-35-32(29(2)3)26-23-27-33(35)30(4)5/h19-21,23-27,29-30,34H,6-18,22,28H2,1-5H3,(H,38,39)