3-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide

Systemtic Name: 3-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide Openeye Name: 3-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]-N-(2-methyl-8-quinolyl)cyclohexanecarboxamide CAS Name: 3-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]-N-(2-methyl-8-quinolinyl)-1-cyclohexanecarboxamide IUPAC Name: 3-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]-N-(2-methylquinolin-8-yl)cyclohexane-1-carboxamide Traditional Name: 3-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]-N-(2-methyl-8-quinolyl)cyclohexanecarboxamide Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC(=O)C3CCCC(C3)CNCC4=CC5=C(C=C4)OCCO5)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC(=O)C3CCCC(C3)CNCC4=CC5=C(C=C4)OCCO5)C=C1

InChI

InChI=1S/C27H31N3O3/c1-18-8-10-21-5-3-7-23(26(21)29-18)30-27(31)22-6-2-4-19(14-22)16-28-17-20-9-11-24-25(15-20)33-13-12-32-24/h3,5,7-11,15,19,22,28H,2,4,6,12-14,16-17H2,1H3,(H,30,31)