2-ethanoyl-1-heptyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 2-ethanoyl-1-heptyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 2-acetyl-1-heptyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid CAS Name: 2-acetyl-1-heptyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 2-acetyl-1-heptyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 2-acetyl-1-heptyl-1,3,4,9-tetrahydro-$b-carboline-3-carboxylic acid Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C2=C(CC(N1C(=O)C)C(=O)O)C3=CC=CC=C3N2

Isomeric SMILES

CCCCCCCC1C2=C(CC(N1C(=O)C)C(=O)O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H28N2O3/c1-3-4-5-6-7-12-18-20-16(15-10-8-9-11-17(15)22-20)13-19(21(25)26)23(18)14(2)24/h8-11,18-19,22H,3-7,12-13H2,1-2H3,(H,25,26)