(3R)-N-cyclopropyl-N-(quinolin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-cyclopropyl-N-(quinolin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-cyclopropyl-N-(3-quinolylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-cyclopropyl-N-(3-quinolinylmethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-cyclopropyl-N-(quinolin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-cyclopropyl-N-(3-quinolylmethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC3=CC=CC=C3N=C2)C(=O)C4COC5=CC=CC=C5O4

Isomeric SMILES

C1CC1N(CC2=CC3=CC=CC=C3N=C2)C(=O)[C@H]4COC5=CC=CC=C5O4

InChI

InChI=1S/C22H20N2O3/c25-22(21-14-26-19-7-3-4-8-20(19)27-21)24(17-9-10-17)13-15-11-16-5-1-2-6-18(16)23-12-15/h1-8,11-12,17,21H,9-10,13-14H2/t21-/m1/s1