4-methyl-6-[(1E)-3-methylbuta-1,3-dienyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 4-methyl-6-[(1E)-3-methylbuta-1,3-dienyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 4-methyl-6-[(1E)-3-methylbuta-1,3-dienyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 4-methyl-6-[(1E)-3-methylbuta-1,3-dienyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 4-methyl-6-[(1E)-3-methylbuta-1,3-dienyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 4-methyl-6-[(1E)-3-methylbuta-1,3-dienyl]-9H-$b-carboline-3-carboxylic acid Formula: C18H16N2O2 MolecularWeight: 292.33184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C3=C(C=CC(=C3)C=CC(=C)C)NC2=CN=C1C(=O)O

Isomeric SMILES

CC1=C2C3=C(C=CC(=C3)/C=C/C(=C)C)NC2=CN=C1C(=O)O

InChI

InChI=1S/C18H16N2O2/c1-10(2)4-5-12-6-7-14-13(8-12)16-11(3)17(18(21)22)19-9-15(16)20-14/h4-9,20H,1H2,2-3H3,(H,21,22)/b5-4+