1-[(3S,3aS)-7-methoxy-3-phenyl-3a,4-dihydro-3H-chromeno[4,3-c]pyrazol-2-yl]ethanone

Systemtic Name: 1-[(3S,3aS)-7-methoxy-3-phenyl-3a,4-dihydro-3H-chromeno[4,3-c]pyrazol-2-yl]ethanone Openeye Name: 1-[(3S,3aS)-7-methoxy-3-phenyl-3a,4-dihydro-3H-chromeno[4,3-c]pyrazol-2-yl]ethanone CAS Name: 1-[(3S,3aS)-7-methoxy-3-phenyl-3a,4-dihydro-3H-[1]benzopyrano[4,3-c]pyrazol-2-yl]ethanone IUPAC Name: 1-[(3S,3aS)-7-methoxy-3-phenyl-3a,4-dihydro-3H-chromeno[4,3-c]pyrazol-2-yl]ethanone Traditional Name: 1-[(3S,3aS)-7-methoxy-3-phenyl-3a,4-dihydro-3H-chromeno[4,3-c]pyrazol-2-yl]ethanone Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C2COC3=C(C2=N1)C=CC(=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1[C@@H]([C@@H]2COC3=C(C2=N1)C=CC(=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C19H18N2O3/c1-12(22)21-19(13-6-4-3-5-7-13)16-11-24-17-10-14(23-2)8-9-15(17)18(16)20-21/h3-10,16,19H,11H2,1-2H3/t16-,19-/m1/s1