[2-[[(2S)-6-methylheptan-2-yl]amino]-2-oxidanylidene-ethyl] 3-acetamidobenzoate

Systemtic Name: [2-[[(2S)-6-methylheptan-2-yl]amino]-2-oxidanylidene-ethyl] 3-acetamidobenzoate Openeye Name: [2-[[(1S)-1,5-dimethylhexyl]amino]-2-oxo-ethyl] 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [2-[[(2S)-6-methylheptan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-6-methylheptan-2-yl]amino]-2-oxoethyl] 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [2-[[(1S)-1,5-dimethylhexyl]amino]-2-keto-ethyl] ester Formula: C19H28N2O4 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)COC(=O)C1=CC(=CC=C1)NC(=O)C

Isomeric SMILES

C[C@@H](CCCC(C)C)NC(=O)COC(=O)C1=CC(=CC=C1)NC(=O)C

InChI

InChI=1S/C19H28N2O4/c1-13(2)7-5-8-14(3)20-18(23)12-25-19(24)16-9-6-10-17(11-16)21-15(4)22/h6,9-11,13-14H,5,7-8,12H2,1-4H3,(H,20,23)(H,21,22)/t14-/m0/s1