1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(1-phenylpyrazol-4-yl)carbonylphenoxy]ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(1-phenylpyrazol-4-yl)carbonylphenoxy]ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(1-phenylpyrazole-4-carbonyl)phenoxy]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-[oxo-(1-phenyl-4-pyrazolyl)methyl]phenoxy]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(1-phenylpyrazole-4-carbonyl)phenoxy]ethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(1-phenylpyrazole-4-carbonyl)phenoxy]ethanone Formula: C27H23N3O3 MolecularWeight: 437.48982

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)COC3=CC=CC=C3C(=O)C4=CN(N=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)COC3=CC=CC=C3C(=O)C4=CN(N=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H23N3O3/c31-26(29-15-14-20-8-4-5-9-21(20)17-29)19-33-25-13-7-6-12-24(25)27(32)22-16-28-30(18-22)23-10-2-1-3-11-23/h1-13,16,18H,14-15,17,19H2