N-[4-[(3R)-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]piperidin-1-yl]carbonylphenyl]ethanamide

Systemtic Name: N-[4-[(3R)-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]piperidin-1-yl]carbonylphenyl]ethanamide Openeye Name: N-[4-[(3R)-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxo-propyl]piperidine-1-carbonyl]phenyl]acetamide CAS Name: N-[4-[[(3R)-3-[3-(4-methyl-1-piperazin-4-iumyl)-3-oxopropyl]-1-piperidinyl]-oxomethyl]phenyl]acetamide IUPAC Name: N-[4-[(3R)-3-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxopropyl]piperidine-1-carbonyl]phenyl]acetamide Traditional Name: N-[4-[(3R)-3-[3-keto-3-(4-methylpiperazin-4-ium-1-yl)propyl]piperidine-1-carbonyl]phenyl]acetamide Formula: C22H33N4O3+ MolecularWeight: 401.52242

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)N2CCCC(C2)CCC(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)N2CCC[C@@H](C2)CCC(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C22H32N4O3/c1-17(27)23-20-8-6-19(7-9-20)22(29)26-11-3-4-18(16-26)5-10-21(28)25-14-12-24(2)13-15-25/h6-9,18H,3-5,10-16H2,1-2H3,(H,23,27)/p+1/t18-/m1/s1