N-(2,5-dimethoxyphenyl)-2-[4-(9H-fluoren-9-yl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-2-[4-(9H-fluoren-9-yl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2,5-dimethoxyphenyl)-2-[4-(9H-fluoren-9-yl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2,5-dimethoxyphenyl)-2-[4-(9H-fluoren-9-yl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,5-dimethoxyphenyl)-2-[4-(9H-fluoren-9-yl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,5-dimethoxyphenyl)-2-[4-(9H-fluoren-9-yl)piperazin-1-ium-1-yl]acetamide Formula: C27H30N3O3+ MolecularWeight: 444.5454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C[NH+]2CCN(CC2)C3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)C[NH+]2CCN(CC2)C3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C27H29N3O3/c1-32-19-11-12-25(33-2)24(17-19)28-26(31)18-29-13-15-30(16-14-29)27-22-9-5-3-7-20(22)21-8-4-6-10-23(21)27/h3-12,17,27H,13-16,18H2,1-2H3,(H,28,31)/p+1