[2-[[2-[(2R)-butan-2-yl]phenyl]amino]-2-oxidanylidene-ethyl] 3,5-ditert-butylbenzoate

Systemtic Name: [2-[[2-[(2R)-butan-2-yl]phenyl]amino]-2-oxidanylidene-ethyl] 3,5-ditert-butylbenzoate Openeye Name: [2-[2-[(1R)-1-methylpropyl]anilino]-2-oxo-ethyl] 3,5-ditert-butylbenzoate CAS Name: 3,5-ditert-butylbenzoic acid [2-[2-[(2R)-butan-2-yl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-[(2R)-butan-2-yl]anilino]-2-oxoethyl] 3,5-ditert-butylbenzoate Traditional Name: 3,5-ditert-butylbenzoic acid [2-keto-2-[2-[(1R)-1-methylpropyl]anilino]ethyl] ester Formula: C27H37NO3 MolecularWeight: 423.58758

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)COC(=O)C2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC[C@@H](C)C1=CC=CC=C1NC(=O)COC(=O)C2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C27H37NO3/c1-9-18(2)22-12-10-11-13-23(22)28-24(29)17-31-25(30)19-14-20(26(3,4)5)16-21(15-19)27(6,7)8/h10-16,18H,9,17H2,1-8H3,(H,28,29)/t18-/m1/s1