2-[1,5-bis(oxidanyl)-5-oxidanylidene-pentyl]-6-methyl-3-phenethyl-1H-indole-5-carboxylic acid

Systemtic Name: 2-[1,5-bis(oxidanyl)-5-oxidanylidene-pentyl]-6-methyl-3-phenethyl-1H-indole-5-carboxylic acid Openeye Name: 2-(1,5-dihydroxy-5-oxo-pentyl)-6-methyl-3-phenethyl-1H-indole-5-carboxylic acid CAS Name: 2-(1,5-dihydroxy-5-oxopentyl)-6-methyl-3-phenethyl-1H-indole-5-carboxylic acid IUPAC Name: 2-(1,5-dihydroxy-5-oxopentyl)-6-methyl-3-phenethyl-1H-indole-5-carboxylic acid Traditional Name: 2-(1,5-dihydroxy-5-keto-pentyl)-6-methyl-3-phenethyl-1H-indole-5-carboxylic acid Formula: C23H25NO5 MolecularWeight: 395.4483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)NC(=C2CCC3=CC=CC=C3)C(CCCC(=O)O)O)C(=O)O

Isomeric SMILES

CC1=C(C=C2C(=C1)NC(=C2CCC3=CC=CC=C3)C(CCCC(=O)O)O)C(=O)O

InChI

InChI=1S/C23H25NO5/c1-14-12-19-18(13-17(14)23(28)29)16(11-10-15-6-3-2-4-7-15)22(24-19)20(25)8-5-9-21(26)27/h2-4,6-7,12-13,20,24-25H,5,8-11H2,1H3,(H,26,27)(H,28,29)