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

Systemtic Name: 4-(methoxymethyl)-6-phenethyl-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 4-(methoxymethyl)-6-phenethyl-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 4-(methoxymethyl)-6-phenethyl-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 4-(methoxymethyl)-6-phenethyl-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 4-(methoxymethyl)-6-phenethyl-9H-$b-carboline-3-carboxylic acid Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C2C3=C(C=CC(=C3)CCC4=CC=CC=C4)NC2=CN=C1C(=O)O

Isomeric SMILES

COCC1=C2C3=C(C=CC(=C3)CCC4=CC=CC=C4)NC2=CN=C1C(=O)O

InChI

InChI=1S/C22H20N2O3/c1-27-13-17-20-16-11-15(8-7-14-5-3-2-4-6-14)9-10-18(16)24-19(20)12-23-21(17)22(25)26/h2-6,9-12,24H,7-8,13H2,1H3,(H,25,26)