N-(1H-indol-4-ylmethyl)-2-[(2R)-1-[(2-methoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-(1H-indol-4-ylmethyl)-2-[(2R)-1-[(2-methoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide Openeye Name: N-(1H-indol-4-ylmethyl)-2-[(2R)-1-[(2-methoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]acetamide CAS Name: N-(1H-indol-4-ylmethyl)-2-[(2R)-1-[(2-methoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-(1H-indol-4-ylmethyl)-2-[(2R)-1-[(2-methoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]acetamide Traditional Name: N-(1H-indol-4-ylmethyl)-2-[(2R)-3-keto-1-o-anisyl-piperazin-1-ium-2-yl]acetamide Formula: C23H27N4O3+ MolecularWeight: 407.48548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C[NH+]2CCNC(=O)C2CC(=O)NCC3=C4C=CNC4=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C[NH+]2CCNC(=O)[C@H]2CC(=O)NCC3=C4C=CNC4=CC=C3

InChI

InChI=1S/C23H26N4O3/c1-30-21-8-3-2-5-17(21)15-27-12-11-25-23(29)20(27)13-22(28)26-14-16-6-4-7-19-18(16)9-10-24-19/h2-10,20,24H,11-15H2,1H3,(H,25,29)(H,26,28)/p+1/t20-/m1/s1