5-(4-ethoxycarbonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 5-(4-ethoxycarbonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 5-(4-ethoxycarbonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 5-(4-ethoxycarbonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 5-(4-ethoxycarbonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 5-(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=CC=CC3=C2C4=C(C(=NC=C4N3)C(=O)O)COC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC2=CC=CC3=C2C4=C(C(=NC=C4N3)C(=O)O)COC

InChI

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