2-[(1-ethanoylindol-3-yl)methyl]-3-oxidanyl-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid

Systemtic Name: 2-[(1-ethanoylindol-3-yl)methyl]-3-oxidanyl-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid Openeye Name: 2-[(1-acetylindol-3-yl)methyl]-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid CAS Name: 2-[(1-acetyl-3-indolyl)methyl]-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid IUPAC Name: 2-[(1-acetylindol-3-yl)methyl]-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid Traditional Name: 2-[(1-acetylindol-3-yl)methyl]-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=C(C2=CC=CC=C21)CC3=C(C(=C4C=CC5=C(C4=N3)CCCC5)C(=O)O)O

Isomeric SMILES

CC(=O)N1C=C(C2=CC=CC=C21)CC3=C(C(=C4C=CC5=C(C4=N3)CCCC5)C(=O)O)O

InChI

InChI=1S/C25H22N2O4/c1-14(28)27-13-16(17-7-4-5-9-21(17)27)12-20-24(29)22(25(30)31)19-11-10-15-6-2-3-8-18(15)23(19)26-20/h4-5,7,9-11,13,29H,2-3,6,8,12H2,1H3,(H,30,31)