N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-oxo-chromene-3-carboxamide CAS Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-oxochromene-3-carboxamide Traditional Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-keto-chromene-3-carboxamide Formula: C30H33N4O3+ MolecularWeight: 497.60802

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=CC3=CC=CC=C3OC2=O)[NH+]4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H](CNC(=O)C2=CC3=CC=CC=C3OC2=O)[NH+]4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C30H32N4O3/c1-32(2)24-14-12-22(13-15-24)27(34-18-16-33(17-19-34)25-9-4-3-5-10-25)21-31-29(35)26-20-23-8-6-7-11-28(23)37-30(26)36/h3-15,20,27H,16-19,21H2,1-2H3,(H,31,35)/p+1/t27-/m0/s1