6-[4-[(dimethylazaniumyl)methyl]phenyl]-1H-indole-2-carboxylate

Systemtic Name: 6-[4-[(dimethylazaniumyl)methyl]phenyl]-1H-indole-2-carboxylate Openeye Name: 6-[4-[(dimethylammonio)methyl]phenyl]-1H-indole-2-carboxylate CAS Name: 6-[4-[(dimethylammonio)methyl]phenyl]-1H-indole-2-carboxylate IUPAC Name: 6-[4-[(dimethylazaniumyl)methyl]phenyl]-1H-indole-2-carboxylate Traditional Name: 6-[4-[(dimethylammonio)methyl]phenyl]-1H-indole-2-carboxylate Formula: C18H18N2O2 MolecularWeight: 294.34772

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)C2=CC3=C(C=C2)C=C(N3)C(=O)[O-]

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)C2=CC3=C(C=C2)C=C(N3)C(=O)[O-]

InChI

InChI=1S/C18H18N2O2/c1-20(2)11-12-3-5-13(6-4-12)14-7-8-15-10-17(18(21)22)19-16(15)9-14/h3-10,19H,11H2,1-2H3,(H,21,22)