methyl 4-methyl-3-[2-[(2S)-2-[(3-methylphenyl)carbonylamino]propanoyl]oxyethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[(2S)-2-[(3-methylphenyl)carbonylamino]propanoyl]oxyethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[(2S)-2-[(3-methylbenzoyl)amino]propanoyl]oxyacetyl]amino]benzoate CAS Name: 4-methyl-3-[[2-[(2S)-2-[[(3-methylphenyl)-oxomethyl]amino]-1-oxopropoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[(2S)-2-[(3-methylbenzoyl)amino]propanoyl]oxyacetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[(2S)-2-(m-toluoylamino)propanoyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)C(C)NC(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)[C@H](C)NC(=O)C2=CC(=CC=C2)C

InChI

InChI=1S/C22H24N2O6/c1-13-6-5-7-16(10-13)20(26)23-15(3)21(27)30-12-19(25)24-18-11-17(22(28)29-4)9-8-14(18)2/h5-11,15H,12H2,1-4H3,(H,23,26)(H,24,25)/t15-/m0/s1