[1-[(2-chloranylpyridin-3-yl)amino]-1-oxidanylidene-propan-2-yl] 3-(ethoxycarbonylamino)benzoate

Systemtic Name: [1-[(2-chloranylpyridin-3-yl)amino]-1-oxidanylidene-propan-2-yl] 3-(ethoxycarbonylamino)benzoate Openeye Name: [2-[(2-chloro-3-pyridyl)amino]-1-methyl-2-oxo-ethyl] 3-(ethoxycarbonylamino)benzoate CAS Name: 3-(ethoxycarbonylamino)benzoic acid [1-[(2-chloro-3-pyridinyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(2-chloropyridin-3-yl)amino]-1-oxopropan-2-yl] 3-(ethoxycarbonylamino)benzoate Traditional Name: 3-(carbethoxyamino)benzoic acid [2-[(2-chloro-3-pyridyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C18H18ClN3O5 MolecularWeight: 391.80562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC=CC(=C1)C(=O)OC(C)C(=O)NC2=C(N=CC=C2)Cl

Isomeric SMILES

CCOC(=O)NC1=CC=CC(=C1)C(=O)OC(C)C(=O)NC2=C(N=CC=C2)Cl

InChI

InChI=1S/C18H18ClN3O5/c1-3-26-18(25)21-13-7-4-6-12(10-13)17(24)27-11(2)16(23)22-14-8-5-9-20-15(14)19/h4-11H,3H2,1-2H3,(H,21,25)(H,22,23)