N-[2-[4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]carbonylphenyl]-4-chloranyl-benzamide

Systemtic Name: N-[2-[4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]carbonylphenyl]-4-chloranyl-benzamide Openeye Name: N-[2-[4-[2-(tert-butylamino)-2-oxo-ethyl]piperazin-4-ium-1-carbonyl]phenyl]-4-chloro-benzamide CAS Name: N-[2-[[4-[2-(tert-butylamino)-2-oxoethyl]-1-piperazin-4-iumyl]-oxomethyl]phenyl]-4-chlorobenzamide IUPAC Name: N-[2-[4-[2-(tert-butylamino)-2-oxoethyl]piperazin-4-ium-1-carbonyl]phenyl]-4-chlorobenzamide Traditional Name: N-[2-[4-[2-(tert-butylamino)-2-keto-ethyl]piperazin-4-ium-1-carbonyl]phenyl]-4-chloro-benzamide Formula: C24H30ClN4O3+ MolecularWeight: 457.973

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H29ClN4O3/c1-24(2,3)27-21(30)16-28-12-14-29(15-13-28)23(32)19-6-4-5-7-20(19)26-22(31)17-8-10-18(25)11-9-17/h4-11H,12-16H2,1-3H3,(H,26,31)(H,27,30)/p+1