(3R)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide

Systemtic Name: (3R)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide Openeye Name: (3R)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-5-oxo-1-phenethyl-pyrrolidine-3-carboxamide CAS Name: (3R)-N-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylphenyl]-5-oxo-1-phenethyl-3-pyrrolidinecarboxamide IUPAC Name: (3R)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylphenyl]-5-oxo-1-phenethylpyrrolidine-3-carboxamide Traditional Name: (3R)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-5-keto-1-phenethyl-pyrrolidine-3-carboxamide Formula: C26H35N4O2+ MolecularWeight: 435.5817

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3CC(=O)N(C3)CCC4=CC=CC=C4)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)[C@@H]3CC(=O)N(C3)CCC4=CC=CC=C4)C

InChI

InChI=1S/C26H34N4O2/c1-3-28-13-15-29(16-14-28)24-10-9-23(17-20(24)2)27-26(32)22-18-25(31)30(19-22)12-11-21-7-5-4-6-8-21/h4-10,17,22H,3,11-16,18-19H2,1-2H3,(H,27,32)/p+1/t22-/m1/s1