1-(5-ethylthiophen-2-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 1-(5-ethylthiophen-2-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 1-(5-ethyl-2-thienyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 1-(5-ethyl-2-thiophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 1-(5-ethylthiophen-2-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 1-(5-ethyl-2-thienyl)-2,3,4,9-tetrahydro-1H-$b-carboline-3-carboxylic acid Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2C3=C(CC(N2)C(=O)O)C4=CC=CC=C4N3

Isomeric SMILES

CCC1=CC=C(S1)C2C3=C(CC(N2)C(=O)O)C4=CC=CC=C4N3

InChI

InChI=1S/C18H18N2O2S/c1-2-10-7-8-15(23-10)17-16-12(9-14(20-17)18(21)22)11-5-3-4-6-13(11)19-16/h3-8,14,17,19-20H,2,9H2,1H3,(H,21,22)