(phenylmethyl) N-[(2S)-1-(3,4-dihydro-1H-phthalazin-2-yl)-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-(3,4-dihydro-1H-phthalazin-2-yl)-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-(3,4-dihydro-1H-phthalazine-2-carbonyl)-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-(3,4-dihydro-1H-phthalazin-2-yl)-3-methyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-(3,4-dihydro-1H-phthalazin-2-yl)-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-(3,4-dihydro-1H-phthalazine-2-carbonyl)-2-methyl-propyl]carbamic acid benzyl ester Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CC2=CC=CC=C2CN1)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CC2=CC=CC=C2CN1)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O3/c1-15(2)19(23-21(26)27-14-16-8-4-3-5-9-16)20(25)24-13-18-11-7-6-10-17(18)12-22-24/h3-11,15,19,22H,12-14H2,1-2H3,(H,23,26)/t19-/m0/s1