sodium 9-ethyl-1-propyl-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: sodium 9-ethyl-1-propyl-pyrido[3,4-b]indole-3-carboxylate Openeye Name: sodium 9-ethyl-1-propyl-pyrido[3,4-b]indole-3-carboxylate CAS Name: sodium 9-ethyl-1-propyl-3-pyrido[3,4-b]indolecarboxylate IUPAC Name: sodium 9-ethyl-1-propylpyrido[3,4-b]indole-3-carboxylate Traditional Name: sodium 9-ethyl-1-propyl-$b-carboline-3-carboxylate Formula: C17H17N2NaO2 MolecularWeight: 304.31885

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC(=N1)C(=O)[O-])C3=CC=CC=C3N2CC.[Na+]

Isomeric SMILES

CCCC1=C2C(=CC(=N1)C(=O)[O-])C3=CC=CC=C3N2CC.[Na+]

InChI

InChI=1S/C17H18N2O2.Na/c1-3-7-13-16-12(10-14(18-13)17(20)21)11-8-5-6-9-15(11)19(16)4-2;/h5-6,8-10H,3-4,7H2,1-2H3,(H,20,21);/q;+1/p-1