tert-butyl 3-azanyl-4-[(5-chloranylpyridin-2-yl)carbamoyl]benzoate

Systemtic Name: tert-butyl 3-azanyl-4-[(5-chloranylpyridin-2-yl)carbamoyl]benzoate Openeye Name: tert-butyl 3-amino-4-[(5-chloro-2-pyridyl)carbamoyl]benzoate CAS Name: 3-amino-4-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 3-amino-4-[(5-chloropyridin-2-yl)carbamoyl]benzoate Traditional Name: 3-amino-4-[(5-chloro-2-pyridyl)carbamoyl]benzoic acid tert-butyl ester Formula: C17H18ClN3O3 MolecularWeight: 347.79612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)C(=O)NC2=NC=C(C=C2)Cl)N

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)C(=O)NC2=NC=C(C=C2)Cl)N

InChI

InChI=1S/C17H18ClN3O3/c1-17(2,3)24-16(23)10-4-6-12(13(19)8-10)15(22)21-14-7-5-11(18)9-20-14/h4-9H,19H2,1-3H3,(H,20,21,22)