tert-butyl 2,3-diaminocarbonyl-6-(1-azanylpropyl)benzoate

Systemtic Name: tert-butyl 2,3-diaminocarbonyl-6-(1-azanylpropyl)benzoate Openeye Name: tert-butyl 6-(1-aminopropyl)-2,3-dicarbamoyl-benzoate CAS Name: 6-(1-aminopropyl)-2,3-dicarbamoylbenzoic acid tert-butyl ester IUPAC Name: tert-butyl 6-(1-aminopropyl)-2,3-dicarbamoylbenzoate Traditional Name: 6-(1-aminopropyl)-2,3-dicarbamoyl-benzoic acid tert-butyl ester Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C(=C(C=C1)C(=O)N)C(=O)N)C(=O)OC(C)(C)C)N

Isomeric SMILES

CCC(C1=C(C(=C(C=C1)C(=O)N)C(=O)N)C(=O)OC(C)(C)C)N

InChI

InChI=1S/C16H23N3O4/c1-5-10(17)8-6-7-9(13(18)20)11(14(19)21)12(8)15(22)23-16(2,3)4/h6-7,10H,5,17H2,1-4H3,(H2,18,20)(H2,19,21)