(1R,3R)-1-butyl-2-ethanoyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate

Systemtic Name: (1R,3R)-1-butyl-2-ethanoyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate Openeye Name: (1R,3R)-2-acetyl-1-butyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate CAS Name: (1R,3R)-2-acetyl-1-butyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate IUPAC Name: (1R,3R)-2-acetyl-1-butyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate Traditional Name: (1R,3R)-2-acetyl-1-butyl-1,3,4,9-tetrahydro-$b-carboline-3-carboxylate Formula: C18H21N2O3- MolecularWeight: 313.37094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C2=C(CC(N1C(=O)C)C(=O)[O-])C3=CC=CC=C3N2

Isomeric SMILES

CCCC[C@@H]1C2=C(C[C@@H](N1C(=O)C)C(=O)[O-])C3=CC=CC=C3N2

InChI

InChI=1S/C18H22N2O3/c1-3-4-9-15-17-13(12-7-5-6-8-14(12)19-17)10-16(18(22)23)20(15)11(2)21/h5-8,15-16,19H,3-4,9-10H2,1-2H3,(H,22,23)/p-1/t15-,16-/m1/s1