3-(4-ethanoyl-5-methyl-furan-2-yl)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: 3-(4-ethanoyl-5-methyl-furan-2-yl)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]propan-1-one Openeye Name: 3-(4-acetyl-5-methyl-2-furyl)-1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]propan-1-one CAS Name: 3-(4-acetyl-5-methyl-2-furanyl)-1-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 3-(4-acetyl-5-methylfuran-2-yl)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]propan-1-one Traditional Name: 3-(4-acetyl-5-methyl-2-furyl)-1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]propan-1-one Formula: C25H29N2O3+ MolecularWeight: 405.50936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CCC(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)C(=O)C

Isomeric SMILES

CC1=C(C=C(O1)CCC(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)C(=O)C

InChI

InChI=1S/C25H28N2O3/c1-18(28)24-16-22(30-19(24)2)10-11-25(29)27-14-12-26(13-15-27)17-21-8-5-7-20-6-3-4-9-23(20)21/h3-9,16H,10-15,17H2,1-2H3/p+1