3-azanyl-6-methyl-8-[4-(4-phenylbutoxy)phenyl]carbonyl-2-(2H-1,2,3,4-tetrazol-5-yl)chromen-4-one

Systemtic Name: 3-azanyl-6-methyl-8-[4-(4-phenylbutoxy)phenyl]carbonyl-2-(2H-1,2,3,4-tetrazol-5-yl)chromen-4-one Openeye Name: 3-amino-6-methyl-8-[4-(4-phenylbutoxy)benzoyl]-2-(2H-tetrazol-5-yl)chromen-4-one CAS Name: 3-amino-6-methyl-8-[oxo-[4-(4-phenylbutoxy)phenyl]methyl]-2-(2H-tetrazol-5-yl)-1-benzopyran-4-one IUPAC Name: 3-amino-6-methyl-8-[4-(4-phenylbutoxy)benzoyl]-2-(2H-tetrazol-5-yl)chromen-4-one Traditional Name: 3-amino-6-methyl-8-[4-(4-phenylbutoxy)benzoyl]-2-(2H-tetrazol-5-yl)chromone Formula: C28H25N5O4 MolecularWeight: 495.5292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=NNN=N3)N)C(=O)C4=CC=C(C=C4)OCCCCC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=NNN=N3)N)C(=O)C4=CC=C(C=C4)OCCCCC5=CC=CC=C5

InChI

InChI=1S/C28H25N5O4/c1-17-15-21(26-22(16-17)25(35)23(29)27(37-26)28-30-32-33-31-28)24(34)19-10-12-20(13-11-19)36-14-6-5-9-18-7-3-2-4-8-18/h2-4,7-8,10-13,15-16H,5-6,9,14,29H2,1H3,(H,30,31,32,33)