N-(2-methoxyethyl)-2-[(2R)-1-[(4-methoxy-3-methyl-phenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-propan-2-yl-ethanamide

Systemtic Name: N-(2-methoxyethyl)-2-[(2R)-1-[(4-methoxy-3-methyl-phenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-N-(2-methoxyethyl)-2-[(2R)-1-[(4-methoxy-3-methyl-phenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]acetamide CAS Name: N-(2-methoxyethyl)-2-[(2R)-1-[(4-methoxy-3-methylphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: N-(2-methoxyethyl)-2-[(2R)-1-[(4-methoxy-3-methylphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[(2R)-3-keto-1-(4-methoxy-3-methyl-benzyl)piperazin-1-ium-2-yl]-N-(2-methoxyethyl)acetamide Formula: C21H34N3O4+ MolecularWeight: 392.51236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C[NH+]2CCNC(=O)C2CC(=O)N(CCOC)C(C)C)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C[NH+]2CCNC(=O)[C@H]2CC(=O)N(CCOC)C(C)C)OC

InChI

InChI=1S/C21H33N3O4/c1-15(2)24(10-11-27-4)20(25)13-18-21(26)22-8-9-23(18)14-17-6-7-19(28-5)16(3)12-17/h6-7,12,15,18H,8-11,13-14H2,1-5H3,(H,22,26)/p+1/t18-/m1/s1