ethyl N-[4-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2-oxidanylidene-chromen-7-yl]carbamate

Systemtic Name: ethyl N-[4-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2-oxidanylidene-chromen-7-yl]carbamate Openeye Name: ethyl N-[4-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2-oxo-chromen-7-yl]carbamate CAS Name: N-[4-[[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-2-oxo-1-benzopyran-7-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-2-oxochromen-7-yl]carbamate Traditional Name: N-[2-keto-4-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]chromen-7-yl]carbamic acid ethyl ester Formula: C24H28N3O5+ MolecularWeight: 438.49622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+]3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+]3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H27N3O5/c1-3-31-24(29)25-18-4-9-21-17(14-23(28)32-22(21)15-18)16-26-10-12-27(13-11-26)19-5-7-20(30-2)8-6-19/h4-9,14-15H,3,10-13,16H2,1-2H3,(H,25,29)/p+1