4-(2,5-dimethylpyrrol-1-yl)-N-[2-oxidanylidene-2-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]ethyl]benzamide

Systemtic Name: 4-(2,5-dimethylpyrrol-1-yl)-N-[2-oxidanylidene-2-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]ethyl]benzamide Openeye Name: 4-(2,5-dimethylpyrrol-1-yl)-N-[2-oxo-2-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-4-ium-1-yl]ethyl]benzamide CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)-N-[2-oxo-2-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazin-4-iumyl]ethyl]benzamide IUPAC Name: 4-(2,5-dimethylpyrrol-1-yl)-N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-4-ium-1-yl]ethyl]benzamide Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)-N-[2-keto-2-[4-(2-keto-2-piperidino-ethyl)piperazin-4-ium-1-yl]ethyl]benzamide Formula: C26H36N5O3+ MolecularWeight: 466.59574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)NCC(=O)N3CC[NH+](CC3)CC(=O)N4CCCCC4)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)NCC(=O)N3CC[NH+](CC3)CC(=O)N4CCCCC4)C

InChI

InChI=1S/C26H35N5O3/c1-20-6-7-21(2)31(20)23-10-8-22(9-11-23)26(34)27-18-24(32)30-16-14-28(15-17-30)19-25(33)29-12-4-3-5-13-29/h6-11H,3-5,12-19H2,1-2H3,(H,27,34)/p+1