(phenylmethyl) N-[(1S)-1-[(3S)-8-methoxy-1-oxidanylidene-3,4-dihydroisochromen-3-yl]-3-methyl-butyl]carbamate

Systemtic Name: (phenylmethyl) N-[(1S)-1-[(3S)-8-methoxy-1-oxidanylidene-3,4-dihydroisochromen-3-yl]-3-methyl-butyl]carbamate Openeye Name: benzyl N-[(1S)-1-[(3S)-8-methoxy-1-oxo-isochroman-3-yl]-3-methyl-butyl]carbamate CAS Name: N-[(1S)-1-[(3S)-8-methoxy-1-oxo-3,4-dihydro-1H-2-benzopyran-3-yl]-3-methylbutyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(1S)-1-[(3S)-8-methoxy-1-oxo-3,4-dihydroisochromen-3-yl]-3-methylbutyl]carbamate Traditional Name: N-[(1S)-1-[(3S)-1-keto-8-methoxy-isochroman-3-yl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1CC2=C(C(=CC=C2)OC)C(=O)O1)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C[C@@H]([C@@H]1CC2=C(C(=CC=C2)OC)C(=O)O1)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H27NO5/c1-15(2)12-18(24-23(26)28-14-16-8-5-4-6-9-16)20-13-17-10-7-11-19(27-3)21(17)22(25)29-20/h4-11,15,18,20H,12-14H2,1-3H3,(H,24,26)/t18-,20-/m0/s1