N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[2-[4-(furan-2-ylmethyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[2-[4-(furan-2-ylmethyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[2-[4-(2-furylmethyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[2-[4-(2-furanylmethyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[2-[4-(furan-2-ylmethyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[2-[4-(2-furfuryl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C26H30ClN4O4+ MolecularWeight: 497.9938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)CC4=CC=CO4

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)CC4=CC=CO4

InChI

InChI=1S/C26H29ClN4O4/c1-18-14-23(24(34-2)15-21(18)27)29-26(33)20-7-3-4-8-22(20)28-25(32)17-31-11-9-30(10-12-31)16-19-6-5-13-35-19/h3-8,13-15H,9-12,16-17H2,1-2H3,(H,28,32)(H,29,33)/p+1