methyl 1-(2-ethoxycarbonyl-1-oxidanyl-prop-2-enyl)-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: methyl 1-(2-ethoxycarbonyl-1-oxidanyl-prop-2-enyl)-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: methyl 1-(2-ethoxycarbonyl-1-hydroxy-allyl)-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-(2-ethoxycarbonyl-1-hydroxyprop-2-enyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid methyl ester IUPAC Name: methyl 1-(2-ethoxycarbonyl-1-hydroxyprop-2-enyl)-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 1-(2-carbethoxy-1-hydroxy-allyl)-9H-$b-carboline-3-carboxylic acid methyl ester Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C)C(C1=C2C(=CC(=N1)C(=O)OC)C3=CC=CC=C3N2)O

Isomeric SMILES

CCOC(=O)C(=C)C(C1=C2C(=CC(=N1)C(=O)OC)C3=CC=CC=C3N2)O

InChI

InChI=1S/C19H18N2O5/c1-4-26-18(23)10(2)17(22)16-15-12(9-14(21-16)19(24)25-3)11-7-5-6-8-13(11)20-15/h5-9,17,20,22H,2,4H2,1,3H3