(2S)-N-ethyl-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-N-naphthalen-1-yl-propanamide

Systemtic Name: (2S)-N-ethyl-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-N-naphthalen-1-yl-propanamide Openeye Name: (2S)-N-ethyl-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-N-(1-naphthyl)propanamide CAS Name: (2S)-N-ethyl-2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-N-(1-naphthalenyl)propanamide IUPAC Name: (2S)-N-ethyl-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-N-naphthalen-1-ylpropanamide Traditional Name: (2S)-N-ethyl-2-[4-(2-furoyl)piperazin-1-ium-1-yl]-N-(1-naphthyl)propionamide Formula: C24H28N3O3+ MolecularWeight: 406.49742

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC2=CC=CC=C21)C(=O)C(C)[NH+]3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CCN(C1=CC=CC2=CC=CC=C21)C(=O)[C@H](C)[NH+]3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C24H27N3O3/c1-3-27(21-11-6-9-19-8-4-5-10-20(19)21)23(28)18(2)25-13-15-26(16-14-25)24(29)22-12-7-17-30-22/h4-12,17-18H,3,13-16H2,1-2H3/p+1/t18-/m0/s1