7-[(3-naphthalen-1-yloxy-2-oxidanyl-propyl)amino]octanoic acid

Systemtic Name: 7-[(3-naphthalen-1-yloxy-2-oxidanyl-propyl)amino]octanoic acid Openeye Name: 7-[[2-hydroxy-3-(1-naphthyloxy)propyl]amino]octanoic acid CAS Name: 7-[[2-hydroxy-3-(1-naphthalenyloxy)propyl]amino]octanoic acid IUPAC Name: 7-[(2-hydroxy-3-naphthalen-1-yloxypropyl)amino]octanoic acid Traditional Name: 7-[[2-hydroxy-3-(1-naphthoxy)propyl]amino]caprylic acid Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCC(=O)O)NCC(COC1=CC=CC2=CC=CC=C21)O

Isomeric SMILES

CC(CCCCCC(=O)O)NCC(COC1=CC=CC2=CC=CC=C21)O

InChI

InChI=1S/C21H29NO4/c1-16(8-3-2-4-13-21(24)25)22-14-18(23)15-26-20-12-7-10-17-9-5-6-11-19(17)20/h5-7,9-12,16,18,22-23H,2-4,8,13-15H2,1H3,(H,24,25)