(3S)-2-butanoyl-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: (3S)-2-butanoyl-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: (3S)-2-butanoyl-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-3-carboxylate CAS Name: (3S)-9-methyl-2-(1-oxobutyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-3-carboxylate IUPAC Name: (3S)-2-butanoyl-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: (3S)-2-butyryl-9-methyl-3,4-dihydro-1H-$b-carboline-3-carboxylate Formula: C17H19N2O3- MolecularWeight: 299.34436

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CC2=C(CC1C(=O)[O-])C3=CC=CC=C3N2C

Isomeric SMILES

CCCC(=O)N1CC2=C(C[C@H]1C(=O)[O-])C3=CC=CC=C3N2C

InChI

InChI=1S/C17H20N2O3/c1-3-6-16(20)19-10-15-12(9-14(19)17(21)22)11-7-4-5-8-13(11)18(15)2/h4-5,7-8,14H,3,6,9-10H2,1-2H3,(H,21,22)/p-1/t14-/m0/s1