2-(4-ethylpiperazin-4-ium-1-yl)-5,6,7,8-tetrahydroquinazoline-4-carboxylate

Systemtic Name: 2-(4-ethylpiperazin-4-ium-1-yl)-5,6,7,8-tetrahydroquinazoline-4-carboxylate Openeye Name: 2-(4-ethylpiperazin-4-ium-1-yl)-5,6,7,8-tetrahydroquinazoline-4-carboxylate CAS Name: 2-(4-ethyl-1-piperazin-4-iumyl)-5,6,7,8-tetrahydroquinazoline-4-carboxylate IUPAC Name: 2-(4-ethylpiperazin-4-ium-1-yl)-5,6,7,8-tetrahydroquinazoline-4-carboxylate Traditional Name: 2-(4-ethylpiperazin-4-ium-1-yl)-5,6,7,8-tetrahydroquinazoline-4-carboxylate Formula: C15H22N4O2 MolecularWeight: 290.36078

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC(=C3CCCCC3=N2)C(=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC(=C3CCCCC3=N2)C(=O)[O-]

InChI

InChI=1S/C15H22N4O2/c1-2-18-7-9-19(10-8-18)15-16-12-6-4-3-5-11(12)13(17-15)14(20)21/h2-10H2,1H3,(H,20,21)