N-[2-[4-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]furan-2-carboxamide

Systemtic Name: N-[2-[4-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]furan-2-carboxamide Openeye Name: N-[2-[4-[2-(4-methylanilino)-2-oxo-ethyl]piperazin-4-ium-1-yl]-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[2-[4-[2-(4-methylanilino)-2-oxoethyl]-1-piperazin-4-iumyl]-2-oxoethyl]-2-furancarboxamide IUPAC Name: N-[2-[4-[2-(4-methylanilino)-2-oxoethyl]piperazin-4-ium-1-yl]-2-oxoethyl]furan-2-carboxamide Traditional Name: N-[2-keto-2-[4-[2-keto-2-(p-toluidino)ethyl]piperazin-4-ium-1-yl]ethyl]-2-furamide Formula: C20H25N4O4+ MolecularWeight: 385.4369

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)CNC(=O)C3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)CNC(=O)C3=CC=CO3

InChI

InChI=1S/C20H24N4O4/c1-15-4-6-16(7-5-15)22-18(25)14-23-8-10-24(11-9-23)19(26)13-21-20(27)17-3-2-12-28-17/h2-7,12H,8-11,13-14H2,1H3,(H,21,27)(H,22,25)/p+1