[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-(3-methoxy-4-phenylmethoxy-phenyl)methanone

Systemtic Name: [4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-(3-methoxy-4-phenylmethoxy-phenyl)methanone Openeye Name: (4-benzyloxy-3-methoxy-phenyl)-[4-(2-furylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [4-(2-furanylmethyl)-1-piperazin-4-iumyl]-(3-methoxy-4-phenylmethoxyphenyl)methanone IUPAC Name: [4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-(3-methoxy-4-phenylmethoxyphenyl)methanone Traditional Name: (4-benzoxy-3-methoxy-phenyl)-[4-(2-furfuryl)piperazin-4-ium-1-yl]methanone Formula: C24H27N2O4+ MolecularWeight: 407.48218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CC=CO3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CC=CO3)OCC4=CC=CC=C4

InChI

InChI=1S/C24H26N2O4/c1-28-23-16-20(9-10-22(23)30-18-19-6-3-2-4-7-19)24(27)26-13-11-25(12-14-26)17-21-8-5-15-29-21/h2-10,15-16H,11-14,17-18H2,1H3/p+1