methyl N-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanoyl]carbamate

Systemtic Name: methyl N-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanoyl]carbamate Openeye Name: methyl N-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]carbamate CAS Name: N-[2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]carbamate Traditional Name: N-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]carbamic acid methyl ester Formula: C14H20N3O4+ MolecularWeight: 294.3263

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=O)C[NH+]1CCN(CC1)C2=CC=C(C=C2)O

Isomeric SMILES

COC(=O)NC(=O)C[NH+]1CCN(CC1)C2=CC=C(C=C2)O

InChI

InChI=1S/C14H19N3O4/c1-21-14(20)15-13(19)10-16-6-8-17(9-7-16)11-2-4-12(18)5-3-11/h2-5,18H,6-10H2,1H3,(H,15,19,20)/p+1