1-[[4-(azepan-1-ylcarbonyl)piperidin-1-yl]methyl]-5-methyl-indole-2,3-dione

Systemtic Name: 1-[[4-(azepan-1-ylcarbonyl)piperidin-1-yl]methyl]-5-methyl-indole-2,3-dione Openeye Name: 1-[[4-(azepane-1-carbonyl)-1-piperidyl]methyl]-5-methyl-indoline-2,3-dione CAS Name: 1-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]methyl]-5-methylindole-2,3-dione IUPAC Name: 1-[[4-(azepane-1-carbonyl)piperidin-1-yl]methyl]-5-methylindole-2,3-dione Traditional Name: 1-[[4-(azepane-1-carbonyl)piperidino]methyl]-5-methyl-isatin Formula: C22H29N3O3 MolecularWeight: 383.48396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C2=O)CN3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C2=O)CN3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C22H29N3O3/c1-16-6-7-19-18(14-16)20(26)22(28)25(19)15-23-12-8-17(9-13-23)21(27)24-10-4-2-3-5-11-24/h6-7,14,17H,2-5,8-13,15H2,1H3