4-(propanoylamino)-2-[(4-propan-2-yloxycarbonylphenyl)carbonylamino]benzoate

Systemtic Name: 4-(propanoylamino)-2-[(4-propan-2-yloxycarbonylphenyl)carbonylamino]benzoate Openeye Name: 2-[(4-isopropoxycarbonylbenzoyl)amino]-4-(propanoylamino)benzoate CAS Name: 2-[[oxo-[4-[oxo(propan-2-yloxy)methyl]phenyl]methyl]amino]-4-(1-oxopropylamino)benzoate IUPAC Name: 4-(propanoylamino)-2-[(4-propan-2-yloxycarbonylbenzoyl)amino]benzoate Traditional Name: 2-[(4-isopropoxycarbonylbenzoyl)amino]-4-propionamido-benzoate Formula: C21H21N2O6- MolecularWeight: 397.40124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)C(=O)[O-])NC(=O)C2=CC=C(C=C2)C(=O)OC(C)C

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)C(=O)[O-])NC(=O)C2=CC=C(C=C2)C(=O)OC(C)C

InChI

InChI=1S/C21H22N2O6/c1-4-18(24)22-15-9-10-16(20(26)27)17(11-15)23-19(25)13-5-7-14(8-6-13)21(28)29-12(2)3/h5-12H,4H2,1-3H3,(H,22,24)(H,23,25)(H,26,27)/p-1