7-chloranyl-6-phenylmethoxy-2,3,9,9a-tetrahydro-1H-pyrrolo[1,2-a]azepine-5,8-dione

Systemtic Name: 7-chloranyl-6-phenylmethoxy-2,3,9,9a-tetrahydro-1H-pyrrolo[1,2-a]azepine-5,8-dione Openeye Name: 6-benzyloxy-7-chloro-2,3,9,9a-tetrahydro-1H-pyrrolo[1,2-a]azepine-5,8-dione CAS Name: 7-chloro-6-phenylmethoxy-2,3,9,9a-tetrahydro-1H-pyrrolo[1,2-a]azepine-5,8-dione IUPAC Name: 7-chloro-6-phenylmethoxy-2,3,9,9a-tetrahydro-1H-pyrrolo[1,2-a]azepine-5,8-dione Traditional Name: 6-benzoxy-7-chloro-2,3,9,9a-tetrahydro-1H-pyrrol[1,2-a]azepine-5,8-quinone Formula: C16H16ClNO3 MolecularWeight: 305.75614

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(=O)C(=C(C(=O)N2C1)OCC3=CC=CC=C3)Cl

Isomeric SMILES

C1CC2CC(=O)C(=C(C(=O)N2C1)OCC3=CC=CC=C3)Cl

InChI

InChI=1S/C16H16ClNO3/c17-14-13(19)9-12-7-4-8-18(12)16(20)15(14)21-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2