6-(2-ethanoylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 6-(2-ethanoylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 6-(2-acetylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 6-(2-acetylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 6-(2-acetylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 6-(2-acetylphenoxy)-4-(methoxymethyl)-9H-$b-carboline-3-carboxylic acid Formula: C22H18N2O5 MolecularWeight: 390.38872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1OC2=CC3=C(C=C2)NC4=CN=C(C(=C34)COC)C(=O)O

Isomeric SMILES

CC(=O)C1=CC=CC=C1OC2=CC3=C(C=C2)NC4=CN=C(C(=C34)COC)C(=O)O

InChI

InChI=1S/C22H18N2O5/c1-12(25)14-5-3-4-6-19(14)29-13-7-8-17-15(9-13)20-16(11-28-2)21(22(26)27)23-10-18(20)24-17/h3-10,24H,11H2,1-2H3,(H,26,27)