2-(1,2-benzoxazol-3-yl)-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]ethanamide

Systemtic Name: 2-(1,2-benzoxazol-3-yl)-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]ethanamide Openeye Name: 2-(1,2-benzoxazol-3-yl)-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide CAS Name: 2-(1,2-benzoxazol-3-yl)-N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]acetamide IUPAC Name: 2-(1,2-benzoxazol-3-yl)-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Traditional Name: 2-indoxazen-3-yl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)CC3=NOC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)CC3=NOC4=CC=CC=C43

InChI

InChI=1S/C21H24N4O2/c1-15-13-16(25-11-9-24(2)10-12-25)7-8-18(15)22-21(26)14-19-17-5-3-4-6-20(17)27-23-19/h3-8,13H,9-12,14H2,1-2H3,(H,22,26)/p+1