6-(4-ethoxycarbonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 6-(4-ethoxycarbonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 6-(4-ethoxycarbonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 6-(4-ethoxycarbonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 6-(4-ethoxycarbonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 6-(4-carbethoxyphenoxy)-4-(methoxymethyl)-9H-$b-carboline-3-carboxylic acid Formula: C23H20N2O6 MolecularWeight: 420.4147

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC2=CC3=C(C=C2)NC4=CN=C(C(=C34)COC)C(=O)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC2=CC3=C(C=C2)NC4=CN=C(C(=C34)COC)C(=O)O

InChI

InChI=1S/C23H20N2O6/c1-3-30-23(28)13-4-6-14(7-5-13)31-15-8-9-18-16(10-15)20-17(12-29-2)21(22(26)27)24-11-19(20)25-18/h4-11,25H,3,12H2,1-2H3,(H,26,27)