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

Systemtic Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: 4-(2-keto-1,3-benzoxazol-3-yl)-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]butyramide Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)CCCN3C4=CC=CC=C4OC3=O

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)CCCN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C23H28N4O3/c1-17-16-18(26-14-12-25(2)13-15-26)9-10-19(17)24-22(28)8-5-11-27-20-6-3-4-7-21(20)30-23(27)29/h3-4,6-7,9-10,16H,5,8,11-15H2,1-2H3,(H,24,28)/p+1