[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxidanylidene-ethyl] 4-acetamidobenzoate

Systemtic Name: [2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxidanylidene-ethyl] 4-acetamidobenzoate Openeye Name: [2-[[(1R)-1,4-dimethylpentyl]amino]-2-oxo-ethyl] 4-acetamidobenzoate CAS Name: 4-acetamidobenzoic acid [2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethyl] 4-acetamidobenzoate Traditional Name: 4-acetamidobenzoic acid [2-[[(1R)-1,4-dimethylpentyl]amino]-2-keto-ethyl] ester Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O4/c1-12(2)5-6-13(3)19-17(22)11-24-18(23)15-7-9-16(10-8-15)20-14(4)21/h7-10,12-13H,5-6,11H2,1-4H3,(H,19,22)(H,20,21)/t13-/m1/s1