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

Systemtic Name: methyl 1-(2-methoxycarbonyl-1-oxidanyl-prop-2-enyl)-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: methyl 1-(1-hydroxy-2-methoxycarbonyl-allyl)-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-(1-hydroxy-2-methoxycarbonylprop-2-enyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid methyl ester IUPAC Name: methyl 1-(1-hydroxy-2-methoxycarbonylprop-2-enyl)-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 1-(2-carbomethoxy-1-hydroxy-allyl)-9H-$b-carboline-3-carboxylic acid methyl ester Formula: C18H16N2O5 MolecularWeight: 340.33004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C(C(=C)C(=O)OC)O

Isomeric SMILES

COC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C(C(=C)C(=O)OC)O

InChI

InChI=1S/C18H16N2O5/c1-9(17(22)24-2)16(21)15-14-11(8-13(20-15)18(23)25-3)10-6-4-5-7-12(10)19-14/h4-8,16,19,21H,1H2,2-3H3