(E)-3-(6-chloranyl-2H-chromen-3-yl)-N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]prop-2-enamide

Systemtic Name: (E)-3-(6-chloranyl-2H-chromen-3-yl)-N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]prop-2-enamide Openeye Name: (E)-3-(6-chloro-2H-chromen-3-yl)-N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]prop-2-enamide CAS Name: (E)-3-(6-chloro-2H-1-benzopyran-3-yl)-N-methyl-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-2-propenamide IUPAC Name: (E)-3-(6-chloro-2H-chromen-3-yl)-N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]prop-2-enamide Traditional Name: (E)-3-(6-chloro-2H-chromen-3-yl)-N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-N-methyl-acrylamide Formula: C20H25ClN3O3+ MolecularWeight: 390.8838

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN(C)C(=O)C=CC2=CC3=C(C=CC(=C3)Cl)OC2

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN(C)C(=O)/C=C/C2=CC3=C(C=CC(=C3)Cl)OC2

InChI

InChI=1S/C20H24ClN3O3/c1-22-7-9-24(10-8-22)20(26)13-23(2)19(25)6-3-15-11-16-12-17(21)4-5-18(16)27-14-15/h3-6,11-12H,7-10,13-14H2,1-2H3/p+1/b6-3+