(3R)-N-[(4-ethylphenyl)methyl]-N-(pyridin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-[(4-ethylphenyl)methyl]-N-(pyridin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-[(4-ethylphenyl)methyl]-N-(3-pyridylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-[(4-ethylphenyl)methyl]-N-(3-pyridinylmethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-[(4-ethylphenyl)methyl]-N-(pyridin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-(4-ethylbenzyl)-N-(3-pyridylmethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C24H24N2O3 MolecularWeight: 388.45896

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CCC1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=O)[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C24H24N2O3/c1-2-18-9-11-19(12-10-18)15-26(16-20-6-5-13-25-14-20)24(27)23-17-28-21-7-3-4-8-22(21)29-23/h3-14,23H,2,15-17H2,1H3/t23-/m1/s1