methyl 1-(2,3,4,5-tetrahydro-1-benzofuran-5-yl)-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: methyl 1-(2,3,4,5-tetrahydro-1-benzofuran-5-yl)-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: methyl 1-(2,3,4,5-tetrahydrobenzofuran-5-yl)-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-(2,3,4,5-tetrahydrobenzofuran-5-yl)-9H-pyrido[3,4-b]indole-3-carboxylic acid methyl ester IUPAC Name: methyl 1-(2,3,4,5-tetrahydro-1-benzofuran-5-yl)-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 1-(2,3,4,5-tetrahydrobenzofuran-5-yl)-9H-$b-carboline-3-carboxylic acid methyl ester Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C4CC5=C(C=C4)OCC5

Isomeric SMILES

COC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C4CC5=C(C=C4)OCC5

InChI

InChI=1S/C21H18N2O3/c1-25-21(24)17-11-15-14-4-2-3-5-16(14)22-20(15)19(23-17)13-6-7-18-12(10-13)8-9-26-18/h2-7,11,13,22H,8-10H2,1H3