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

Systemtic Name: 6-(4-ethanoylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 6-(4-acetylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 6-(4-acetylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 6-(4-acetylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 6-(4-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=C(C=C1)OC2=CC3=C(C=C2)NC4=CN=C(C(=C34)COC)C(=O)O

Isomeric SMILES

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

InChI

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