[4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]-(1H-indazol-3-yl)methanone

Systemtic Name: [4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]-(1H-indazol-3-yl)methanone Openeye Name: [4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]-(1H-indazol-3-yl)methanone CAS Name: [4-[(4-ethoxyphenyl)methyl]-1-piperazin-4-iumyl]-(1H-indazol-3-yl)methanone IUPAC Name: [4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]-(1H-indazol-3-yl)methanone Traditional Name: [4-(4-ethoxybenzyl)piperazin-4-ium-1-yl]-(1H-indazol-3-yl)methanone Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=NNC4=CC=CC=C43

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=NNC4=CC=CC=C43

InChI

InChI=1S/C21H24N4O2/c1-2-27-17-9-7-16(8-10-17)15-24-11-13-25(14-12-24)21(26)20-18-5-3-4-6-19(18)22-23-20/h3-10H,2,11-15H2,1H3,(H,22,23)/p+1