N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-methyl-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-methyl-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-N-methyl-2-[4-(2-pyridylmethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-methyl-2-[4-(2-pyridinylmethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-methyl-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-benzoxy-3-methoxy-benzyl)-N-methyl-2-[4-(2-pyridylmethyl)piperazin-1-ium-1-yl]acetamide Formula: C28H35N4O3+ MolecularWeight: 475.6025

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C(=O)C[NH+]3CCN(CC3)CC4=CC=CC=N4

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C(=O)C[NH+]3CCN(CC3)CC4=CC=CC=N4

InChI

InChI=1S/C28H34N4O3/c1-30(28(33)21-32-16-14-31(15-17-32)20-25-10-6-7-13-29-25)19-24-11-12-26(27(18-24)34-2)35-22-23-8-4-3-5-9-23/h3-13,18H,14-17,19-22H2,1-2H3/p+1