(3S)-N-(phenylmethyl)-N-(pyridin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3S)-N-(phenylmethyl)-N-(pyridin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3S)-N-benzyl-N-(3-pyridylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3S)-N-(phenylmethyl)-N-(3-pyridinylmethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3S)-N-benzyl-N-(pyridin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3S)-N-benzyl-N-(3-pyridylmethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)N(CC3=CC=CC=C3)CC4=CN=CC=C4

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)C(=O)N(CC3=CC=CC=C3)CC4=CN=CC=C4

InChI

InChI=1S/C22H20N2O3/c25-22(21-16-26-19-10-4-5-11-20(19)27-21)24(14-17-7-2-1-3-8-17)15-18-9-6-12-23-13-18/h1-13,21H,14-16H2/t21-/m0/s1