[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] 4-butylbenzoate

Systemtic Name: [2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] 4-butylbenzoate Openeye Name: [2-[(5-chloro-2-pyridyl)amino]-2-oxo-ethyl] 4-butylbenzoate CAS Name: 4-butylbenzoic acid [2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl] 4-butylbenzoate Traditional Name: 4-butylbenzoic acid [2-[(5-chloro-2-pyridyl)amino]-2-keto-ethyl] ester Formula: C18H19ClN2O3 MolecularWeight: 346.80806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)OCC(=O)NC2=NC=C(C=C2)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)OCC(=O)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C18H19ClN2O3/c1-2-3-4-13-5-7-14(8-6-13)18(23)24-12-17(22)21-16-10-9-15(19)11-20-16/h5-11H,2-4,12H2,1H3,(H,20,21,22)