2-[[(2Z)-5-(6-azanylhexyl)-6-methyl-2-(6-oxidanylidenenaphthalen-2-ylidene)-1H-pyrimidin-4-yl]oxy]ethanoic acid

Systemtic Name: 2-[[(2Z)-5-(6-azanylhexyl)-6-methyl-2-(6-oxidanylidenenaphthalen-2-ylidene)-1H-pyrimidin-4-yl]oxy]ethanoic acid Openeye Name: 2-[[(2Z)-5-(6-aminohexyl)-6-methyl-2-(6-oxo-2-naphthylidene)-1H-pyrimidin-4-yl]oxy]acetic acid CAS Name: 2-[[(2Z)-5-(6-aminohexyl)-6-methyl-2-(6-oxo-2-naphthalenylidene)-1H-pyrimidin-4-yl]oxy]acetic acid IUPAC Name: 2-[[(2Z)-5-(6-aminohexyl)-6-methyl-2-(6-oxonaphthalen-2-ylidene)-1H-pyrimidin-4-yl]oxy]acetic acid Traditional Name: 2-[[(2Z)-5-(6-aminohexyl)-2-(6-keto-2-naphthylidene)-6-methyl-1H-pyrimidin-4-yl]oxy]acetic acid Formula: C23H27N3O4 MolecularWeight: 409.47818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C2C=CC3=CC(=O)C=CC3=C2)N1)OCC(=O)O)CCCCCCN

Isomeric SMILES

CC1=C(C(=N/C(=C\2/C=CC3=CC(=O)C=CC3=C2)/N1)OCC(=O)O)CCCCCCN

InChI

InChI=1S/C23H27N3O4/c1-15-20(6-4-2-3-5-11-24)23(30-14-21(28)29)26-22(25-15)18-8-7-17-13-19(27)10-9-16(17)12-18/h7-10,12-13,25H,2-6,11,14,24H2,1H3,(H,28,29)/b22-18-