N-[(4-methoxyphenyl)methyl]-4-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-4-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-carboxamide Openeye Name: N-[(4-methoxyphenyl)methyl]-4-[2-(3-methoxypropylamino)-2-oxo-ethyl]piperazin-4-ium-1-carboxamide CAS Name: N-[(4-methoxyphenyl)methyl]-4-[2-(3-methoxypropylamino)-2-oxoethyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-4-[2-(3-methoxypropylamino)-2-oxoethyl]piperazin-4-ium-1-carboxamide Traditional Name: 4-[2-keto-2-(3-methoxypropylamino)ethyl]-N-p-anisyl-piperazin-4-ium-1-carboxamide Formula: C19H31N4O4+ MolecularWeight: 379.47384

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C[NH+]1CCN(CC1)C(=O)NCC2=CC=C(C=C2)OC

Isomeric SMILES

COCCCNC(=O)C[NH+]1CCN(CC1)C(=O)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C19H30N4O4/c1-26-13-3-8-20-18(24)15-22-9-11-23(12-10-22)19(25)21-14-16-4-6-17(27-2)7-5-16/h4-7H,3,8-15H2,1-2H3,(H,20,24)(H,21,25)/p+1