N-[4-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]carbonylphenyl]furan-2-carboxamide

Systemtic Name: N-[4-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]carbonylphenyl]furan-2-carboxamide Openeye Name: N-[4-[4-(o-tolylmethyl)piperazin-4-ium-1-carbonyl]phenyl]furan-2-carboxamide CAS Name: N-[4-[[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-carbonyl]phenyl]furan-2-carboxamide Traditional Name: N-[4-[4-(2-methylbenzyl)piperazin-4-ium-1-carbonyl]phenyl]-2-furamide Formula: C24H26N3O3+ MolecularWeight: 404.48154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C24H25N3O3/c1-18-5-2-3-6-20(18)17-26-12-14-27(15-13-26)24(29)19-8-10-21(11-9-19)25-23(28)22-7-4-16-30-22/h2-11,16H,12-15,17H2,1H3,(H,25,28)/p+1