methyl 2-(3-thiophen-3-ylpropanoyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate

Systemtic Name: methyl 2-(3-thiophen-3-ylpropanoyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Openeye Name: methyl 2-[3-(3-thienyl)propanoyl]-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate CAS Name: 2-[1-oxo-3-(3-thiophenyl)propyl]-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylic acid methyl ester IUPAC Name: methyl 2-(3-thiophen-3-ylpropanoyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Traditional Name: 2-[3-(3-thienyl)propanoyl]-1,3,4,5-tetrahydropyrid[4,3-b]indole-8-carboxylic acid methyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NC3=C2CN(CC3)C(=O)CCC4=CSC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NC3=C2CN(CC3)C(=O)CCC4=CSC=C4

InChI

InChI=1S/C20H20N2O3S/c1-25-20(24)14-3-4-17-15(10-14)16-11-22(8-6-18(16)21-17)19(23)5-2-13-7-9-26-12-13/h3-4,7,9-10,12,21H,2,5-6,8,11H2,1H3