2-chloranyl-13-cyclohexyl-10-methoxycarbonyl-7H-indolo[2,1-a][2]benzazepine-6-carboxylic acid

Systemtic Name: 2-chloranyl-13-cyclohexyl-10-methoxycarbonyl-7H-indolo[2,1-a][2]benzazepine-6-carboxylic acid Openeye Name: 2-chloro-13-cyclohexyl-10-methoxycarbonyl-7H-indolo[2,1-a][2]benzazepine-6-carboxylic acid CAS Name: 2-chloro-13-cyclohexyl-10-methoxycarbonyl-7H-indolo[2,1-a][2]benzazepine-6-carboxylic acid IUPAC Name: 2-chloro-13-cyclohexyl-10-methoxycarbonyl-7H-indolo[2,1-a][2]benzazepine-6-carboxylic acid Traditional Name: 10-carbomethoxy-2-chloro-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-6-carboxylic acid Formula: C26H24ClNO4 MolecularWeight: 449.92606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=C3N2CC(=CC4=C3C=C(C=C4)Cl)C(=O)O)C5CCCCC5

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=C3N2CC(=CC4=C3C=C(C=C4)Cl)C(=O)O)C5CCCCC5

InChI

InChI=1S/C26H24ClNO4/c1-32-26(31)17-8-10-20-22(12-17)28-14-18(25(29)30)11-16-7-9-19(27)13-21(16)24(28)23(20)15-5-3-2-4-6-15/h7-13,15H,2-6,14H2,1H3,(H,29,30)