2-methylpropyl 4-ethyl-N-(2-methylphenyl)carbonyl-piperazin-4-ium-1-carboximidate

Systemtic Name: 2-methylpropyl 4-ethyl-N-(2-methylphenyl)carbonyl-piperazin-4-ium-1-carboximidate Openeye Name: isobutyl 4-ethyl-N-(2-methylbenzoyl)piperazin-4-ium-1-carboximidate CAS Name: 4-ethyl-N-[(2-methylphenyl)-oxomethyl]-1-piperazin-4-iumcarboximidic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-ethyl-N-(2-methylbenzoyl)piperazin-4-ium-1-carboximidate Traditional Name: 4-ethyl-N-o-toluoyl-piperazin-4-ium-1-carboximidic acid isobutyl ester Formula: C19H30N3O2+ MolecularWeight: 332.4604

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=NC(=O)C2=CC=CC=C2C)OCC(C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=NC(=O)C2=CC=CC=C2C)OCC(C)C

InChI

InChI=1S/C19H29N3O2/c1-5-21-10-12-22(13-11-21)19(24-14-15(2)3)20-18(23)17-9-7-6-8-16(17)4/h6-9,15H,5,10-14H2,1-4H3/p+1