N-cyclopropyl-2-[4-[[(3R)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromen-6-yl]carbonyl]piperazin-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[[(3R)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromen-6-yl]carbonyl]piperazin-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[(3R)-1-oxo-3-phenyl-isochromane-6-carbonyl]piperazin-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[oxo-[(3R)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-yl]methyl]-1-piperazinyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[(3R)-1-oxo-3-phenyl-3,4-dihydroisochromene-6-carbonyl]piperazin-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[(3R)-1-keto-3-phenyl-isochroman-6-carbonyl]piperazino]acetamide Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CN2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)OC(C4)C5=CC=CC=C5

Isomeric SMILES

C1CC1NC(=O)CN2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)O[C@H](C4)C5=CC=CC=C5

InChI

InChI=1S/C25H27N3O4/c29-23(26-20-7-8-20)16-27-10-12-28(13-11-27)24(30)18-6-9-21-19(14-18)15-22(32-25(21)31)17-4-2-1-3-5-17/h1-6,9,14,20,22H,7-8,10-13,15-16H2,(H,26,29)/t22-/m1/s1