6-bromanyl-3-[1-phenyl-4-[(phenylmethyl)iminomethyl]pyrazol-3-yl]chromen-2-one

Systemtic Name: 6-bromanyl-3-[1-phenyl-4-[(phenylmethyl)iminomethyl]pyrazol-3-yl]chromen-2-one Openeye Name: 3-[4-(benzyliminomethyl)-1-phenyl-pyrazol-3-yl]-6-bromo-chromen-2-one CAS Name: 6-bromo-3-[1-phenyl-4-[(phenylmethyl)iminomethyl]-3-pyrazolyl]-1-benzopyran-2-one IUPAC Name: 3-[4-(benzyliminomethyl)-1-phenylpyrazol-3-yl]-6-bromochromen-2-one Traditional Name: 3-[4-(benzyliminomethyl)-1-phenyl-pyrazol-3-yl]-6-bromo-coumarin Formula: C26H18BrN3O2 MolecularWeight: 484.34402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN=CC2=CN(N=C2C3=CC4=C(C=CC(=C4)Br)OC3=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN=CC2=CN(N=C2C3=CC4=C(C=CC(=C4)Br)OC3=O)C5=CC=CC=C5

InChI

InChI=1S/C26H18BrN3O2/c27-21-11-12-24-19(13-21)14-23(26(31)32-24)25-20(16-28-15-18-7-3-1-4-8-18)17-30(29-25)22-9-5-2-6-10-22/h1-14,16-17H,15H2