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

Systemtic Name: 5-(4-methanoylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 5-(4-formylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 5-(4-formylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 5-(4-formylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 5-(4-formylphenoxy)-4-(methoxymethyl)-9H-$b-carboline-3-carboxylic acid Formula: C21H16N2O5 MolecularWeight: 376.36214

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C2C(=CN=C1C(=O)O)NC3=C2C(=CC=C3)OC4=CC=C(C=C4)C=O

Isomeric SMILES

COCC1=C2C(=CN=C1C(=O)O)NC3=C2C(=CC=C3)OC4=CC=C(C=C4)C=O

InChI

InChI=1S/C21H16N2O5/c1-27-11-14-18-16(9-22-20(14)21(25)26)23-15-3-2-4-17(19(15)18)28-13-7-5-12(10-24)6-8-13/h2-10,23H,11H2,1H3,(H,25,26)