ethyl 4-[1-[(5-chloranylpyridin-2-yl)amino]-3-oxidanylidene-1H-isoindol-2-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[1-[(5-chloranylpyridin-2-yl)amino]-3-oxidanylidene-1H-isoindol-2-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[1-[(5-chloro-2-pyridyl)amino]-3-oxo-isoindolin-2-yl]piperidine-1-carboxylate CAS Name: 4-[1-[(5-chloro-2-pyridinyl)amino]-3-oxo-1H-isoindol-2-yl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[(5-chloropyridin-2-yl)amino]-3-oxo-1H-isoindol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[1-[(5-chloro-2-pyridyl)amino]-3-keto-isoindolin-2-yl]piperidine-1-carboxylic acid ethyl ester Formula: C21H23ClN4O3 MolecularWeight: 414.88532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2C(C3=CC=CC=C3C2=O)NC4=NC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2C(C3=CC=CC=C3C2=O)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C21H23ClN4O3/c1-2-29-21(28)25-11-9-15(10-12-25)26-19(24-18-8-7-14(22)13-23-18)16-5-3-4-6-17(16)20(26)27/h3-8,13,15,19H,2,9-12H2,1H3,(H,23,24)