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

Systemtic Name: 2-(1-benzothiophen-3-ylmethyl)-3-oxidanyl-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid Openeye Name: 2-(benzothiophen-3-ylmethyl)-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid CAS Name: 2-(1-benzothiophen-3-ylmethyl)-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid IUPAC Name: 2-(1-benzothiophen-3-ylmethyl)-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid Traditional Name: 2-(benzothiophen-3-ylmethyl)-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid Formula: C23H19NO3S MolecularWeight: 389.46686

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CSC5=CC=CC=C54)O)C(=O)O

Isomeric SMILES

C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CSC5=CC=CC=C54)O)C(=O)O

InChI

InChI=1S/C23H19NO3S/c25-22-18(11-14-12-28-19-8-4-3-6-15(14)19)24-21-16-7-2-1-5-13(16)9-10-17(21)20(22)23(26)27/h3-4,6,8-10,12,25H,1-2,5,7,11H2,(H,26,27)