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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC1=C2C3=C(C=CC(=C3)C(=O)OCC4=CC=CC=C4)NC2=CN=C1C(=O)O

Isomeric SMILES

COCC1=C2C3=C(C=CC(=C3)C(=O)OCC4=CC=CC=C4)NC2=CN=C1C(=O)O

InChI

InChI=1S/C22H18N2O5/c1-28-12-16-19-15-9-14(22(27)29-11-13-5-3-2-4-6-13)7-8-17(15)24-18(19)10-23-20(16)21(25)26/h2-10,24H,11-12H2,1H3,(H,25,26)