tert-butyl 2-azanyl-6-[(4-ethynylphenyl)carbonylamino]benzoate

Systemtic Name: tert-butyl 2-azanyl-6-[(4-ethynylphenyl)carbonylamino]benzoate Openeye Name: tert-butyl 2-amino-6-[(4-ethynylbenzoyl)amino]benzoate CAS Name: 2-amino-6-[[(4-ethynylphenyl)-oxomethyl]amino]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-6-[(4-ethynylbenzoyl)amino]benzoate Traditional Name: 2-amino-6-[(4-ethynylbenzoyl)amino]benzoic acid tert-butyl ester Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=CC=C1NC(=O)C2=CC=C(C=C2)C#C)N

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=CC=C1NC(=O)C2=CC=C(C=C2)C#C)N

InChI

InChI=1S/C20H20N2O3/c1-5-13-9-11-14(12-10-13)18(23)22-16-8-6-7-15(21)17(16)19(24)25-20(2,3)4/h1,6-12H,21H2,2-4H3,(H,22,23)