2-[4-(1-naphthalen-1-yl-2-oxidanyl-propyl)piperazin-1-yl]benzoic acid

Systemtic Name: 2-[4-(1-naphthalen-1-yl-2-oxidanyl-propyl)piperazin-1-yl]benzoic acid Openeye Name: 2-[4-[2-hydroxy-1-(1-naphthyl)propyl]piperazin-1-yl]benzoic acid CAS Name: 2-[4-[2-hydroxy-1-(1-naphthalenyl)propyl]-1-piperazinyl]benzoic acid IUPAC Name: 2-[4-(2-hydroxy-1-naphthalen-1-ylpropyl)piperazin-1-yl]benzoic acid Traditional Name: 2-[4-[2-hydroxy-1-(1-naphthyl)propyl]piperazino]benzoic acid Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC2=CC=CC=C21)N3CCN(CC3)C4=CC=CC=C4C(=O)O)O

Isomeric SMILES

CC(C(C1=CC=CC2=CC=CC=C21)N3CCN(CC3)C4=CC=CC=C4C(=O)O)O

InChI

InChI=1S/C24H26N2O3/c1-17(27)23(20-11-6-8-18-7-2-3-9-19(18)20)26-15-13-25(14-16-26)22-12-5-4-10-21(22)24(28)29/h2-12,17,23,27H,13-16H2,1H3,(H,28,29)