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

Systemtic Name: (3S)-N-(4-pyrrolidin-1-ylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3S)-N-(4-pyrrolidin-1-ylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3S)-N-[4-(1-pyrrolidinyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3S)-N-(4-pyrrolidin-1-ylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3S)-N-(4-pyrrolidinophenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C19H20N2O3 MolecularWeight: 324.3737

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O3/c22-19(18-13-23-16-5-1-2-6-17(16)24-18)20-14-7-9-15(10-8-14)21-11-3-4-12-21/h1-2,5-10,18H,3-4,11-13H2,(H,20,22)/t18-/m0/s1