2-methyl-N-[4-[7-(2-methylpropanoyl)-1,2,4,5-tetrahydro-3-benzazepin-3-yl]butyl]quinoline-5-carboxamide

Systemtic Name: 2-methyl-N-[4-[7-(2-methylpropanoyl)-1,2,4,5-tetrahydro-3-benzazepin-3-yl]butyl]quinoline-5-carboxamide Openeye Name: 2-methyl-N-[4-[7-(2-methylpropanoyl)-1,2,4,5-tetrahydro-3-benzazepin-3-yl]butyl]quinoline-5-carboxamide CAS Name: 2-methyl-N-[4-[7-(2-methyl-1-oxopropyl)-1,2,4,5-tetrahydro-3-benzazepin-3-yl]butyl]-5-quinolinecarboxamide IUPAC Name: 2-methyl-N-[4-[7-(2-methylpropanoyl)-1,2,4,5-tetrahydro-3-benzazepin-3-yl]butyl]quinoline-5-carboxamide Traditional Name: N-[4-(7-isobutyryl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)butyl]-2-methyl-quinoline-5-carboxamide Formula: C29H35N3O2 MolecularWeight: 457.6071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC(=C2C=C1)C(=O)NCCCCN3CCC4=C(CC3)C=C(C=C4)C(=O)C(C)C

Isomeric SMILES

CC1=NC2=CC=CC(=C2C=C1)C(=O)NCCCCN3CCC4=C(CC3)C=C(C=C4)C(=O)C(C)C

InChI

InChI=1S/C29H35N3O2/c1-20(2)28(33)24-11-10-22-13-17-32(18-14-23(22)19-24)16-5-4-15-30-29(34)26-7-6-8-27-25(26)12-9-21(3)31-27/h6-12,19-20H,4-5,13-18H2,1-3H3,(H,30,34)