N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-[(1-methylimidazol-2-yl)methyl]quinoline-2-carboxamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-[(1-methylimidazol-2-yl)methyl]quinoline-2-carboxamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-[(1-methylimidazol-2-yl)methyl]quinoline-2-carboxamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-[(1-methyl-2-imidazolyl)methyl]-2-quinolinecarboxamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-[(1-methylimidazol-2-yl)methyl]quinoline-2-carboxamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-[(1-methylimidazol-2-yl)methyl]quinaldamide Formula: C24H22N4O3 MolecularWeight: 414.45648

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1CN(CC2COC3=CC=CC=C3O2)C(=O)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CN1C=CN=C1CN(C[C@H]2COC3=CC=CC=C3O2)C(=O)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C24H22N4O3/c1-27-13-12-25-23(27)15-28(14-18-16-30-21-8-4-5-9-22(21)31-18)24(29)20-11-10-17-6-2-3-7-19(17)26-20/h2-13,18H,14-16H2,1H3/t18-/m0/s1