3-cyclohexyl-1-[2-[2-(4-methylpiperazin-1-yl)ethylamino]-2-oxidanylidene-ethyl]-2-phenyl-indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-1-[2-[2-(4-methylpiperazin-1-yl)ethylamino]-2-oxidanylidene-ethyl]-2-phenyl-indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-1-[2-[2-(4-methylpiperazin-1-yl)ethylamino]-2-oxo-ethyl]-2-phenyl-indole-6-carboxylic acid CAS Name: 3-cyclohexyl-1-[2-[2-(4-methyl-1-piperazinyl)ethylamino]-2-oxoethyl]-2-phenyl-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-1-[2-[2-(4-methylpiperazin-1-yl)ethylamino]-2-oxoethyl]-2-phenylindole-6-carboxylic acid Traditional Name: 3-cyclohexyl-1-[2-keto-2-[2-(4-methylpiperazino)ethylamino]ethyl]-2-phenyl-indole-6-carboxylic acid Formula: C30H38N4O3 MolecularWeight: 502.64772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCNC(=O)CN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

CN1CCN(CC1)CCNC(=O)CN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C30H38N4O3/c1-32-16-18-33(19-17-32)15-14-31-27(35)21-34-26-20-24(30(36)37)12-13-25(26)28(22-8-4-2-5-9-22)29(34)23-10-6-3-7-11-23/h3,6-7,10-13,20,22H,2,4-5,8-9,14-19,21H2,1H3,(H,31,35)(H,36,37)