N-[(4-methoxyphenyl)methyl]-2-[(2R)-1-[(5-methylfuran-2-yl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-2-[(2R)-1-[(5-methylfuran-2-yl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide Openeye Name: N-[(4-methoxyphenyl)methyl]-2-[(2R)-1-[(5-methyl-2-furyl)methyl]-3-oxo-piperazin-1-ium-2-yl]acetamide CAS Name: N-[(4-methoxyphenyl)methyl]-2-[(2R)-1-[(5-methyl-2-furanyl)methyl]-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-2-[(2R)-1-[(5-methylfuran-2-yl)methyl]-3-oxopiperazin-1-ium-2-yl]acetamide Traditional Name: 2-[(2R)-3-keto-1-[(5-methyl-2-furyl)methyl]piperazin-1-ium-2-yl]-N-p-anisyl-acetamide Formula: C20H26N3O4+ MolecularWeight: 372.43814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+]2CCNC(=O)C2CC(=O)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(O1)C[NH+]2CCNC(=O)[C@H]2CC(=O)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H25N3O4/c1-14-3-6-17(27-14)13-23-10-9-21-20(25)18(23)11-19(24)22-12-15-4-7-16(26-2)8-5-15/h3-8,18H,9-13H2,1-2H3,(H,21,25)(H,22,24)/p+1/t18-/m1/s1