N-[3-(3-methylimidazol-3-ium-1-yl)propyl]-4-oxidanyl-1H-indole-2-carboxamide

Systemtic Name: N-[3-(3-methylimidazol-3-ium-1-yl)propyl]-4-oxidanyl-1H-indole-2-carboxamide Openeye Name: 4-hydroxy-N-[3-(3-methylimidazol-3-ium-1-yl)propyl]-1H-indole-2-carboxamide CAS Name: 4-hydroxy-N-[3-(3-methyl-1-imidazol-3-iumyl)propyl]-1H-indole-2-carboxamide IUPAC Name: 4-hydroxy-N-[3-(3-methylimidazol-3-ium-1-yl)propyl]-1H-indole-2-carboxamide Traditional Name: 4-hydroxy-N-[3-(3-methylimidazol-3-ium-1-yl)propyl]-1H-indole-2-carboxamide Formula: C16H19N4O2+ MolecularWeight: 299.34766

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)CCCNC(=O)C2=CC3=C(N2)C=CC=C3O

Isomeric SMILES

C[N+]1=CN(C=C1)CCCNC(=O)C2=CC3=C(N2)C=CC=C3O

InChI

InChI=1S/C16H18N4O2/c1-19-8-9-20(11-19)7-3-6-17-16(22)14-10-12-13(18-14)4-2-5-15(12)21/h2,4-5,8-11H,3,6-7H2,1H3,(H2-,17,18,21,22)/p+1