2-[7-(6-imidazol-1-ylhexoxy)-2-oxidanylidene-5,10-dihydro-3H-imidazo[2,1-b]quinazolin-3-yl]ethanoic acid

Systemtic Name: 2-[7-(6-imidazol-1-ylhexoxy)-2-oxidanylidene-5,10-dihydro-3H-imidazo[2,1-b]quinazolin-3-yl]ethanoic acid Openeye Name: 2-[7-(6-imidazol-1-ylhexoxy)-2-oxo-5,10-dihydro-3H-imidazo[2,1-b]quinazolin-3-yl]acetic acid CAS Name: 2-[7-[6-(1-imidazolyl)hexoxy]-2-oxo-5,10-dihydro-3H-imidazo[2,1-b]quinazolin-3-yl]acetic acid IUPAC Name: 2-[7-(6-imidazol-1-ylhexoxy)-2-oxo-5,10-dihydro-3H-imidazo[2,1-b]quinazolin-3-yl]acetic acid Traditional Name: 2-[7-(6-imidazol-1-ylhexoxy)-2-keto-5,10-dihydro-3H-imidazo[2,1-b]quinazolin-3-yl]acetic acid Formula: C21H25N5O4 MolecularWeight: 411.4543

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)OCCCCCCN3C=CN=C3)NC4=NC(=O)C(N41)CC(=O)O

Isomeric SMILES

C1C2=C(C=CC(=C2)OCCCCCCN3C=CN=C3)NC4=NC(=O)C(N41)CC(=O)O

InChI

InChI=1S/C21H25N5O4/c27-19(28)12-18-20(29)24-21-23-17-6-5-16(11-15(17)13-26(18)21)30-10-4-2-1-3-8-25-9-7-22-14-25/h5-7,9,11,14,18H,1-4,8,10,12-13H2,(H,27,28)(H,23,24,29)