(2R)-N-(ethylcarbamoyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]-2-phenyl-ethanamide

Systemtic Name: (2R)-N-(ethylcarbamoyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]-2-phenyl-ethanamide Openeye Name: (2R)-N-(ethylcarbamoyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]-2-phenyl-acetamide CAS Name: (2R)-N-(ethylcarbamoyl)-2-[4-(2-phenoxyethyl)-1-piperazine-1,4-diiumyl]-2-phenylacetamide IUPAC Name: (2R)-N-(ethylcarbamoyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]-2-phenylacetamide Traditional Name: (2R)-N-(ethylcarbamoyl)-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]-2-phenyl-acetamide Formula: C23H32N4O3+2 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C1=CC=CC=C1)[NH+]2CC[NH+](CC2)CCOC3=CC=CC=C3

Isomeric SMILES

CCNC(=O)NC(=O)[C@@H](C1=CC=CC=C1)[NH+]2CC[NH+](CC2)CCOC3=CC=CC=C3

InChI

InChI=1S/C23H30N4O3/c1-2-24-23(29)25-22(28)21(19-9-5-3-6-10-19)27-15-13-26(14-16-27)17-18-30-20-11-7-4-8-12-20/h3-12,21H,2,13-18H2,1H3,(H2,24,25,28,29)/p+2/t21-/m1/s1