[(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 2-[methyl-(phenylmethyl)carbamoyl]benzoate

Systemtic Name: [(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 2-[methyl-(phenylmethyl)carbamoyl]benzoate Openeye Name: [(1S)-2-(isobutylamino)-1-methyl-2-oxo-ethyl] 2-[benzyl(methyl)carbamoyl]benzoate CAS Name: 2-[[methyl-(phenylmethyl)amino]-oxomethyl]benzoic acid [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] 2-[benzyl(methyl)carbamoyl]benzoate Traditional Name: 2-[benzyl(methyl)carbamoyl]benzoic acid [(1S)-2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)OC(=O)C1=CC=CC=C1C(=O)N(C)CC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NCC(C)C)OC(=O)C1=CC=CC=C1C(=O)N(C)CC2=CC=CC=C2

InChI

InChI=1S/C23H28N2O4/c1-16(2)14-24-21(26)17(3)29-23(28)20-13-9-8-12-19(20)22(27)25(4)15-18-10-6-5-7-11-18/h5-13,16-17H,14-15H2,1-4H3,(H,24,26)/t17-/m0/s1