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

Systemtic Name: 6-chloranyl-7-methyl-4-[[5-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-2-yl]methyl]chromen-2-one Openeye Name: 6-chloro-4-[[5-(4-isopropylphenyl)tetrazol-2-yl]methyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[5-(4-propan-2-ylphenyl)-2-tetrazolyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[[5-(4-propan-2-ylphenyl)tetrazol-2-yl]methyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[(5-p-cumenyltetrazol-2-yl)methyl]coumarin Formula: C21H19ClN4O2 MolecularWeight: 394.85416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3N=C(N=N3)C4=CC=C(C=C4)C(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3N=C(N=N3)C4=CC=C(C=C4)C(C)C)Cl

InChI

InChI=1S/C21H19ClN4O2/c1-12(2)14-4-6-15(7-5-14)21-23-25-26(24-21)11-16-9-20(27)28-19-8-13(3)18(22)10-17(16)19/h4-10,12H,11H2,1-3H3