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

Systemtic Name: 7-oxidanyl-4-[[5-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-2-yl]methyl]chromen-2-one Openeye Name: 7-hydroxy-4-[[5-(4-isopropylphenyl)tetrazol-2-yl]methyl]chromen-2-one CAS Name: 7-hydroxy-4-[[5-(4-propan-2-ylphenyl)-2-tetrazolyl]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[[5-(4-propan-2-ylphenyl)tetrazol-2-yl]methyl]chromen-2-one Traditional Name: 7-hydroxy-4-[(5-p-cumenyltetrazol-2-yl)methyl]coumarin Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NN(N=N2)CC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NN(N=N2)CC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C20H18N4O3/c1-12(2)13-3-5-14(6-4-13)20-21-23-24(22-20)11-15-9-19(26)27-18-10-16(25)7-8-17(15)18/h3-10,12,25H,11H2,1-2H3