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

Systemtic Name: 4-(methoxymethyl)-6-(4-methoxy-2-nitro-phenoxy)-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 4-(methoxymethyl)-6-(4-methoxy-2-nitro-phenoxy)-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 4-(methoxymethyl)-6-(4-methoxy-2-nitrophenoxy)-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 4-(methoxymethyl)-6-(4-methoxy-2-nitrophenoxy)-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 4-(methoxymethyl)-6-(4-methoxy-2-nitro-phenoxy)-9H-$b-carboline-3-carboxylic acid Formula: C21H17N3O7 MolecularWeight: 423.37558

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C2C3=C(C=CC(=C3)OC4=C(C=C(C=C4)OC)[N+](=O)[O-])NC2=CN=C1C(=O)O

Isomeric SMILES

COCC1=C2C3=C(C=CC(=C3)OC4=C(C=C(C=C4)OC)[N+](=O)[O-])NC2=CN=C1C(=O)O

InChI

InChI=1S/C21H17N3O7/c1-29-10-14-19-13-7-12(31-18-6-4-11(30-2)8-17(18)24(27)28)3-5-15(13)23-16(19)9-22-20(14)21(25)26/h3-9,23H,10H2,1-2H3,(H,25,26)