(3S)-N-(4-pyrrolidin-1-ylcarbonylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3S)-N-(4-pyrrolidin-1-ylcarbonylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3S)-N-[4-(pyrrolidine-1-carbonyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3S)-N-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3S)-N-[4-(pyrrolidine-1-carbonyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3S)-N-[4-(pyrrolidine-1-carbonyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)NC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)NC(=O)[C@@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C20H20N2O4/c23-19(18-13-25-16-5-1-2-6-17(16)26-18)21-15-9-7-14(8-10-15)20(24)22-11-3-4-12-22/h1-2,5-10,18H,3-4,11-13H2,(H,21,23)/t18-/m0/s1