N-[(4-methoxyphenyl)-pyridin-4-yl-methyl]-1,3-benzodioxole-2-carboxamide

Systemtic Name: N-[(4-methoxyphenyl)-pyridin-4-yl-methyl]-1,3-benzodioxole-2-carboxamide Openeye Name: N-[(4-methoxyphenyl)-(4-pyridyl)methyl]-1,3-benzodioxole-2-carboxamide CAS Name: N-[(4-methoxyphenyl)-pyridin-4-ylmethyl]-1,3-benzodioxole-2-carboxamide IUPAC Name: N-[(4-methoxyphenyl)-pyridin-4-ylmethyl]-1,3-benzodioxole-2-carboxamide Traditional Name: N-[(4-methoxyphenyl)-(4-pyridyl)methyl]-1,3-benzodioxole-2-carboxamide Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=NC=C2)NC(=O)C3OC4=CC=CC=C4O3

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=NC=C2)NC(=O)C3OC4=CC=CC=C4O3

InChI

InChI=1S/C21H18N2O4/c1-25-16-8-6-14(7-9-16)19(15-10-12-22-13-11-15)23-20(24)21-26-17-4-2-3-5-18(17)27-21/h2-13,19,21H,1H3,(H,23,24)