(3S)-N-(5-chloranyl-2-piperidin-1-yl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3S)-N-(5-chloranyl-2-piperidin-1-yl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3S)-N-[5-chloro-2-(1-piperidyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3S)-N-[5-chloro-2-(1-piperidinyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3S)-N-(5-chloro-2-piperidin-1-ylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3S)-N-(5-chloro-2-piperidino-phenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C20H21ClN2O3 MolecularWeight: 372.84534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)[C@@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C20H21ClN2O3/c21-14-8-9-16(23-10-4-1-5-11-23)15(12-14)22-20(24)19-13-25-17-6-2-3-7-18(17)26-19/h2-3,6-9,12,19H,1,4-5,10-11,13H2,(H,22,24)/t19-/m0/s1