5-[(1-ethylpiperidin-1-ium-4-yl)amino]-2-methyl-isoindole-1,3-dione

Systemtic Name: 5-[(1-ethylpiperidin-1-ium-4-yl)amino]-2-methyl-isoindole-1,3-dione Openeye Name: 5-[(1-ethylpiperidin-1-ium-4-yl)amino]-2-methyl-isoindoline-1,3-dione CAS Name: 5-[(1-ethyl-4-piperidin-1-iumyl)amino]-2-methylisoindole-1,3-dione IUPAC Name: 5-[(1-ethylpiperidin-1-ium-4-yl)amino]-2-methylisoindole-1,3-dione Traditional Name: 5-[(1-ethylpiperidin-1-ium-4-yl)amino]-2-methyl-isoindoline-1,3-quinone Formula: C16H22N3O2+ MolecularWeight: 288.36478

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC2=CC3=C(C=C2)C(=O)N(C3=O)C

Isomeric SMILES

CC[NH+]1CCC(CC1)NC2=CC3=C(C=C2)C(=O)N(C3=O)C

InChI

InChI=1S/C16H21N3O2/c1-3-19-8-6-11(7-9-19)17-12-4-5-13-14(10-12)16(21)18(2)15(13)20/h4-5,10-11,17H,3,6-9H2,1-2H3/p+1