2-azanyl-2-[4-azanyl-1-(4,6-diphenylpyridin-2-yl)oxy-butyl]-3-oxidanylidene-octanoic acid

Systemtic Name: 2-azanyl-2-[4-azanyl-1-(4,6-diphenylpyridin-2-yl)oxy-butyl]-3-oxidanylidene-octanoic acid Openeye Name: 2-amino-2-[4-amino-1-[(4,6-diphenyl-2-pyridyl)oxy]butyl]-3-oxo-octanoic acid CAS Name: 2-amino-2-[4-amino-1-[(4,6-diphenyl-2-pyridinyl)oxy]butyl]-3-oxooctanoic acid IUPAC Name: 2-amino-2-[4-amino-1-(4,6-diphenylpyridin-2-yl)oxybutyl]-3-oxooctanoic acid Traditional Name: 2-amino-2-[4-amino-1-[(4,6-diphenyl-2-pyridyl)oxy]butyl]-3-keto-caprylic acid Formula: C29H35N3O4 MolecularWeight: 489.6059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C(C(CCCN)OC1=CC(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)(C(=O)O)N

Isomeric SMILES

CCCCCC(=O)C(C(CCCN)OC1=CC(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)(C(=O)O)N

InChI

InChI=1S/C29H35N3O4/c1-2-3-6-16-25(33)29(31,28(34)35)26(17-11-18-30)36-27-20-23(21-12-7-4-8-13-21)19-24(32-27)22-14-9-5-10-15-22/h4-5,7-10,12-15,19-20,26H,2-3,6,11,16-18,30-31H2,1H3,(H,34,35)