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

Systemtic Name: [(2R)-tetradecan-2-yl] 3-[[2,6-di(propan-2-yl)phenyl]amino]-3-oxidanylidene-propanoate Openeye Name: [(1R)-1-methyltridecyl] 3-(2,6-diisopropylanilino)-3-oxo-propanoate CAS Name: 3-[2,6-di(propan-2-yl)anilino]-3-oxopropanoic acid [(2R)-tetradecan-2-yl] ester IUPAC Name: [(2R)-tetradecan-2-yl] 3-[2,6-di(propan-2-yl)anilino]-3-oxopropanoate Traditional Name: 3-(2,6-diisopropylanilino)-3-keto-propionic acid [(1R)-1-methyltridecyl] ester Formula: C29H49NO3 MolecularWeight: 459.70426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCCCC[C@@H](C)OC(=O)CC(=O)NC1=C(C=CC=C1C(C)C)C(C)C

InChI

InChI=1S/C29H49NO3/c1-7-8-9-10-11-12-13-14-15-16-18-24(6)33-28(32)21-27(31)30-29-25(22(2)3)19-17-20-26(29)23(4)5/h17,19-20,22-24H,7-16,18,21H2,1-6H3,(H,30,31)/t24-/m1/s1