N-butyl-2-[4-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[(6,7-dimethyl-2-oxo-chromen-4-yl)methyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-butyl-2-[4-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-butyl-2-[4-[(6,7-dimethyl-2-oxochromen-4-yl)methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-butyl-2-[4-[(2-keto-6,7-dimethyl-chromen-4-yl)methyl]piperazin-1-ium-1-yl]acetamide Formula: C22H32N3O3+ MolecularWeight: 386.50778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C[NH+]1CCN(CC1)CC2=CC(=O)OC3=CC(=C(C=C23)C)C

Isomeric SMILES

CCCCNC(=O)C[NH+]1CCN(CC1)CC2=CC(=O)OC3=CC(=C(C=C23)C)C

InChI

InChI=1S/C22H31N3O3/c1-4-5-6-23-21(26)15-25-9-7-24(8-10-25)14-18-13-22(27)28-20-12-17(3)16(2)11-19(18)20/h11-13H,4-10,14-15H2,1-3H3,(H,23,26)/p+1