3-[4-[(3,4-dimethylphenyl)iminomethyl]-1-phenyl-pyrazol-3-yl]chromen-2-one

Systemtic Name: 3-[4-[(3,4-dimethylphenyl)iminomethyl]-1-phenyl-pyrazol-3-yl]chromen-2-one Openeye Name: 3-[4-[(3,4-dimethylphenyl)iminomethyl]-1-phenyl-pyrazol-3-yl]chromen-2-one CAS Name: 3-[4-[(3,4-dimethylphenyl)iminomethyl]-1-phenyl-3-pyrazolyl]-1-benzopyran-2-one IUPAC Name: 3-[4-[(3,4-dimethylphenyl)iminomethyl]-1-phenylpyrazol-3-yl]chromen-2-one Traditional Name: 3-[4-[(3,4-dimethylphenyl)iminomethyl]-1-phenyl-pyrazol-3-yl]coumarin Formula: C27H21N3O2 MolecularWeight: 419.47454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N=CC2=CN(N=C2C3=CC4=CC=CC=C4OC3=O)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)N=CC2=CN(N=C2C3=CC4=CC=CC=C4OC3=O)C5=CC=CC=C5)C

InChI

InChI=1S/C27H21N3O2/c1-18-12-13-22(14-19(18)2)28-16-21-17-30(23-9-4-3-5-10-23)29-26(21)24-15-20-8-6-7-11-25(20)32-27(24)31/h3-17H,1-2H3