(phenylmethyl) N-[(2S)-1-(7-chloranyl-6-oxidanylidene-2H-indazol-1-yl)propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-(7-chloranyl-6-oxidanylidene-2H-indazol-1-yl)propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-2-(7-chloro-6-oxo-2H-indazol-1-yl)-1-methyl-ethyl]carbamate CAS Name: N-[(2S)-1-(7-chloro-6-oxo-2H-indazol-1-yl)propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-(7-chloro-6-oxo-2H-indazol-1-yl)propan-2-yl]carbamate Traditional Name: N-[(1S)-2-(7-chloro-6-keto-2H-indazol-1-yl)-1-methyl-ethyl]carbamic acid benzyl ester Formula: C18H18ClN3O3 MolecularWeight: 359.80682

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=C(C(=O)C=CC2=CN1)Cl)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](CN1C2=C(C(=O)C=CC2=CN1)Cl)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H18ClN3O3/c1-12(21-18(24)25-11-13-5-3-2-4-6-13)10-22-17-14(9-20-22)7-8-15(23)16(17)19/h2-9,12,20H,10-11H2,1H3,(H,21,24)/t12-/m0/s1