(4aS,8aR)-3-(phenylmethyl)-4a,8a-dihydrochromene-2,4-dione

Systemtic Name: (4aS,8aR)-3-(phenylmethyl)-4a,8a-dihydrochromene-2,4-dione Openeye Name: (4aS,8aR)-3-benzyl-4a,8a-dihydrochromene-2,4-dione CAS Name: (4aS,8aR)-3-(phenylmethyl)-4a,8a-dihydro-1-benzopyran-2,4-dione IUPAC Name: (4aS,8aR)-3-benzyl-4a,8a-dihydrochromene-2,4-dione Traditional Name: (4aS,8aR)-3-benzyl-4a,8a-dihydrochromene-2,4-quinone Formula: C16H14O3 MolecularWeight: 254.28056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C(=O)C3C=CC=CC3OC2=O

Isomeric SMILES

C1=CC=C(C=C1)CC2C(=O)[C@H]3C=CC=C[C@H]3OC2=O

InChI

InChI=1S/C16H14O3/c17-15-12-8-4-5-9-14(12)19-16(18)13(15)10-11-6-2-1-3-7-11/h1-9,12-14H,10H2/t12-,13?,14+/m0/s1