(3R)-4-[(2-methoxyphenyl)methyl]-3-[2-(4-methoxypiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-4-ium-2-one

Systemtic Name: (3R)-4-[(2-methoxyphenyl)methyl]-3-[2-(4-methoxypiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-4-ium-2-one Openeye Name: (3R)-4-[(2-methoxyphenyl)methyl]-3-[2-(4-methoxy-1-piperidyl)-2-oxo-ethyl]piperazin-4-ium-2-one CAS Name: (3R)-4-[(2-methoxyphenyl)methyl]-3-[2-(4-methoxy-1-piperidinyl)-2-oxoethyl]-2-piperazin-4-iumone IUPAC Name: (3R)-4-[(2-methoxyphenyl)methyl]-3-[2-(4-methoxypiperidin-1-yl)-2-oxoethyl]piperazin-4-ium-2-one Traditional Name: (3R)-3-[2-keto-2-(4-methoxypiperidino)ethyl]-4-o-anisyl-piperazin-4-ium-2-one Formula: C20H30N3O4+ MolecularWeight: 376.4699

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCN(CC1)C(=O)CC2C(=O)NCC[NH+]2CC3=CC=CC=C3OC

Isomeric SMILES

COC1CCN(CC1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC=CC=C3OC

InChI

InChI=1S/C20H29N3O4/c1-26-16-7-10-22(11-8-16)19(24)13-17-20(25)21-9-12-23(17)14-15-5-3-4-6-18(15)27-2/h3-6,16-17H,7-14H2,1-2H3,(H,21,25)/p+1/t17-/m1/s1