[3-[(2,4-dichlorophenyl)-pyridin-3-yl-methyl]-2,3-dihydro-1,4-benzodioxin-2-yl]methanamine

Systemtic Name: [3-[(2,4-dichlorophenyl)-pyridin-3-yl-methyl]-2,3-dihydro-1,4-benzodioxin-2-yl]methanamine Openeye Name: [3-[(2,4-dichlorophenyl)-(3-pyridyl)methyl]-2,3-dihydro-1,4-benzodioxin-2-yl]methanamine CAS Name: [3-[(2,4-dichlorophenyl)-(3-pyridinyl)methyl]-2,3-dihydro-1,4-benzodioxin-2-yl]methanamine IUPAC Name: [3-[(2,4-dichlorophenyl)-pyridin-3-ylmethyl]-2,3-dihydro-1,4-benzodioxin-2-yl]methanamine Traditional Name: [3-[(2,4-dichlorophenyl)-(3-pyridyl)methyl]-2,3-dihydro-1,4-benzodioxin-2-yl]methylamine Formula: C21H18Cl2N2O2 MolecularWeight: 401.28582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)OC(C(O2)C(C3=CN=CC=C3)C4=C(C=C(C=C4)Cl)Cl)CN

Isomeric SMILES

C1=CC=C2C(=C1)OC(C(O2)C(C3=CN=CC=C3)C4=C(C=C(C=C4)Cl)Cl)CN

InChI

InChI=1S/C21H18Cl2N2O2/c22-14-7-8-15(16(23)10-14)20(13-4-3-9-25-12-13)21-19(11-24)26-17-5-1-2-6-18(17)27-21/h1-10,12,19-21H,11,24H2