3-(3-azaniumylpropyl)-6,7-dimethoxy-1H-indole-2-carboxylate

Systemtic Name: 3-(3-azaniumylpropyl)-6,7-dimethoxy-1H-indole-2-carboxylate Openeye Name: 3-(3-azaniumylpropyl)-6,7-dimethoxy-1H-indole-2-carboxylate CAS Name: 3-(3-ammoniopropyl)-6,7-dimethoxy-1H-indole-2-carboxylate IUPAC Name: 3-(3-azaniumylpropyl)-6,7-dimethoxy-1H-indole-2-carboxylate Traditional Name: 3-(3-ammoniopropyl)-6,7-dimethoxy-1H-indole-2-carboxylate Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(=C(N2)C(=O)[O-])CCC[NH3+])OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=C(N2)C(=O)[O-])CCC[NH3+])OC

InChI

InChI=1S/C14H18N2O4/c1-19-10-6-5-9-8(4-3-7-15)12(14(17)18)16-11(9)13(10)20-2/h5-6,16H,3-4,7,15H2,1-2H3,(H,17,18)