N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-2-methyl-quinoline-4-carboxamide

Systemtic Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-2-methyl-quinoline-4-carboxamide Openeye Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-2-methyl-quinoline-4-carboxamide CAS Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-2-methyl-4-quinolinecarboxamide IUPAC Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-2-methylquinoline-4-carboxamide Traditional Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-2-methyl-cinchoninamide Formula: C24H26N2O3 MolecularWeight: 390.47484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)NC(C3=CC4=C(C=C3)OCCCO4)C(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)N[C@H](C3=CC4=C(C=C3)OCCCO4)C(C)C

InChI

InChI=1S/C24H26N2O3/c1-15(2)23(17-9-10-21-22(14-17)29-12-6-11-28-21)26-24(27)19-13-16(3)25-20-8-5-4-7-18(19)20/h4-5,7-10,13-15,23H,6,11-12H2,1-3H3,(H,26,27)/t23-/m0/s1