4-[[5-(4-bromophenyl)-1,2,3,4-tetrazol-2-yl]methyl]-7-methyl-chromen-2-one

Systemtic Name: 4-[[5-(4-bromophenyl)-1,2,3,4-tetrazol-2-yl]methyl]-7-methyl-chromen-2-one Openeye Name: 4-[[5-(4-bromophenyl)tetrazol-2-yl]methyl]-7-methyl-chromen-2-one CAS Name: 4-[[5-(4-bromophenyl)-2-tetrazolyl]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 4-[[5-(4-bromophenyl)tetrazol-2-yl]methyl]-7-methylchromen-2-one Traditional Name: 4-[[5-(4-bromophenyl)tetrazol-2-yl]methyl]-7-methyl-coumarin Formula: C18H13BrN4O2 MolecularWeight: 397.22542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN3N=C(N=N3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN3N=C(N=N3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C18H13BrN4O2/c1-11-2-7-15-13(9-17(24)25-16(15)8-11)10-23-21-18(20-22-23)12-3-5-14(19)6-4-12/h2-9H,10H2,1H3