methyl 1-(1-benzothiophen-2-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: methyl 1-(1-benzothiophen-2-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: methyl 1-(benzothiophen-2-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-(1-benzothiophen-2-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid methyl ester IUPAC Name: methyl 1-(1-benzothiophen-2-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 1-(benzothiophen-2-yl)-2,3,4,9-tetrahydro-1H-$b-carboline-3-carboxylic acid methyl ester Formula: C21H18N2O2S MolecularWeight: 362.44482

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=C(C(N1)C3=CC4=CC=CC=C4S3)NC5=CC=CC=C25

Isomeric SMILES

COC(=O)C1CC2=C(C(N1)C3=CC4=CC=CC=C4S3)NC5=CC=CC=C25

InChI

InChI=1S/C21H18N2O2S/c1-25-21(24)16-11-14-13-7-3-4-8-15(13)22-19(14)20(23-16)18-10-12-6-2-5-9-17(12)26-18/h2-10,16,20,22-23H,11H2,1H3