N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-methyl-4-oxo-2-phenyl-chromene-8-carboxamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-methyl-4-oxo-2-phenylchromene-8-carboxamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-keto-3-methyl-2-phenyl-chromene-8-carboxamide Formula: C28H27ClN3O3+ MolecularWeight: 488.98528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NC3=C(C=CC(=C3)Cl)N4CC[NH+](CC4)C)C5=CC=CC=C5

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NC3=C(C=CC(=C3)Cl)N4CC[NH+](CC4)C)C5=CC=CC=C5

InChI

InChI=1S/C28H26ClN3O3/c1-18-25(33)21-9-6-10-22(27(21)35-26(18)19-7-4-3-5-8-19)28(34)30-23-17-20(29)11-12-24(23)32-15-13-31(2)14-16-32/h3-12,17H,13-16H2,1-2H3,(H,30,34)/p+1