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

Systemtic Name: hexadecan-2-yl 3-[[2,6-di(propan-2-yl)phenyl]amino]-3-oxidanylidene-propanoate Openeye Name: 1-methylpentadecyl 3-(2,6-diisopropylanilino)-3-oxo-propanoate CAS Name: 3-[2,6-di(propan-2-yl)anilino]-3-oxopropanoic acid hexadecan-2-yl ester IUPAC Name: hexadecan-2-yl 3-[2,6-di(propan-2-yl)anilino]-3-oxopropanoate Traditional Name: 3-(2,6-diisopropylanilino)-3-keto-propionic acid 1-methylpentadecyl ester Formula: C31H53NO3 MolecularWeight: 487.75742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C)OC(=O)CC(=O)NC1=C(C=CC=C1C(C)C)C(C)C

Isomeric SMILES

CCCCCCCCCCCCCCC(C)OC(=O)CC(=O)NC1=C(C=CC=C1C(C)C)C(C)C

InChI

InChI=1S/C31H53NO3/c1-7-8-9-10-11-12-13-14-15-16-17-18-20-26(6)35-30(34)23-29(33)32-31-27(24(2)3)21-19-22-28(31)25(4)5/h19,21-22,24-26H,7-18,20,23H2,1-6H3,(H,32,33)