2-[(2R,4aR)-4a-methyl-3-oxidanylidene-5,6-dihydro-2H-benzo[f][1,4]benzoxazin-2-yl]ethanenitrile

Systemtic Name: 2-[(2R,4aR)-4a-methyl-3-oxidanylidene-5,6-dihydro-2H-benzo[f][1,4]benzoxazin-2-yl]ethanenitrile Openeye Name: 2-[(2R,4aR)-4a-methyl-3-oxo-5,6-dihydro-2H-benzo[f][1,4]benzoxazin-2-yl]acetonitrile CAS Name: 2-[(2R,4aR)-4a-methyl-3-oxo-5,6-dihydro-2H-benzo[f][1,4]benzoxazin-2-yl]acetonitrile IUPAC Name: 2-[(2R,4aR)-4a-methyl-3-oxo-5,6-dihydro-2H-benzo[f][1,4]benzoxazin-2-yl]acetonitrile Traditional Name: 2-[(2R,4aR)-3-keto-4a-methyl-5,6-dihydro-2H-benzo[f][1,4]benzoxazin-2-yl]acetonitrile Formula: C15H14N2O2 MolecularWeight: 254.28386

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3=CC=CC=C3C1=NC(C(=O)O2)CC#N

Isomeric SMILES

C[C@@]12CCC3=CC=CC=C3C1=N[C@@H](C(=O)O2)CC#N

InChI

InChI=1S/C15H14N2O2/c1-15-8-6-10-4-2-3-5-11(10)13(15)17-12(7-9-16)14(18)19-15/h2-5,12H,6-8H2,1H3/t12-,15-/m1/s1