N-butyl-2-[4-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-butyl-2-[4-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-butyl-2-[4-[2-(3-chloro-2-methylanilino)-2-oxoethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-butyl-2-[4-[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]piperazin-1-ium-1-yl]acetamide Formula: C19H30ClN4O2+ MolecularWeight: 381.9201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C[NH+]1CCN(CC1)CC(=O)NC2=C(C(=CC=C2)Cl)C

Isomeric SMILES

CCCCNC(=O)C[NH+]1CCN(CC1)CC(=O)NC2=C(C(=CC=C2)Cl)C

InChI

InChI=1S/C19H29ClN4O2/c1-3-4-8-21-18(25)13-23-9-11-24(12-10-23)14-19(26)22-17-7-5-6-16(20)15(17)2/h5-7H,3-4,8-14H2,1-2H3,(H,21,25)(H,22,26)/p+1