N-(6-methoxypyridin-3-yl)-N-[(2-phenylphenyl)methyl]-1,3-benzodioxole-4-carboxamide

Systemtic Name: N-(6-methoxypyridin-3-yl)-N-[(2-phenylphenyl)methyl]-1,3-benzodioxole-4-carboxamide Openeye Name: N-(6-methoxy-3-pyridyl)-N-[(2-phenylphenyl)methyl]-1,3-benzodioxole-4-carboxamide CAS Name: N-(6-methoxy-3-pyridinyl)-N-[(2-phenylphenyl)methyl]-1,3-benzodioxole-4-carboxamide IUPAC Name: N-(6-methoxypyridin-3-yl)-N-[(2-phenylphenyl)methyl]-1,3-benzodioxole-4-carboxamide Traditional Name: N-(6-methoxy-3-pyridyl)-N-(2-phenylbenzyl)-1,3-benzodioxole-4-carboxamide Formula: C27H22N2O4 MolecularWeight: 438.47458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)N(CC2=CC=CC=C2C3=CC=CC=C3)C(=O)C4=C5C(=CC=C4)OCO5

Isomeric SMILES

COC1=NC=C(C=C1)N(CC2=CC=CC=C2C3=CC=CC=C3)C(=O)C4=C5C(=CC=C4)OCO5

InChI

InChI=1S/C27H22N2O4/c1-31-25-15-14-21(16-28-25)29(27(30)23-12-7-13-24-26(23)33-18-32-24)17-20-10-5-6-11-22(20)19-8-3-2-4-9-19/h2-16H,17-18H2,1H3