ethyl 1-[2-[(4-chloranyl-2,3-dihydro-1-benzofuran-5-yl)methylcarbamoyl]phenyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(4-chloranyl-2,3-dihydro-1-benzofuran-5-yl)methylcarbamoyl]phenyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(4-chloro-2,3-dihydrobenzofuran-5-yl)methylcarbamoyl]phenyl]piperidine-4-carboxylate CAS Name: 1-[2-[[(4-chloro-2,3-dihydrobenzofuran-5-yl)methylamino]-oxomethyl]phenyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(4-chloro-2,3-dihydro-1-benzofuran-5-yl)methylcarbamoyl]phenyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(4-chlorocoumaran-5-yl)methylcarbamoyl]phenyl]isonipecotic acid ethyl ester Formula: C24H27ClN2O4 MolecularWeight: 442.93518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=CC=CC=C2C(=O)NCC3=C(C4=C(C=C3)OCC4)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=CC=CC=C2C(=O)NCC3=C(C4=C(C=C3)OCC4)Cl

InChI

InChI=1S/C24H27ClN2O4/c1-2-30-24(29)16-9-12-27(13-10-16)20-6-4-3-5-18(20)23(28)26-15-17-7-8-21-19(22(17)25)11-14-31-21/h3-8,16H,2,9-15H2,1H3,(H,26,28)