1-[(4S,5S)-4-oxidanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl]pyrrolidin-2-one

Systemtic Name: 1-[(4S,5S)-4-oxidanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl]pyrrolidin-2-one Openeye Name: 1-[(4S,5S)-4-hydroxy-2,3,4,5-tetrahydro-1-benzoxepin-5-yl]pyrrolidin-2-one CAS Name: 1-[(4S,5S)-4-hydroxy-2,3,4,5-tetrahydro-1-benzoxepin-5-yl]-2-pyrrolidinone IUPAC Name: 1-[(4S,5S)-4-hydroxy-2,3,4,5-tetrahydro-1-benzoxepin-5-yl]pyrrolidin-2-one Traditional Name: 1-[(4S,5S)-4-hydroxy-2,3,4,5-tetrahydro-1-benzoxepin-5-yl]-2-pyrrolidone Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2C(CCOC3=CC=CC=C23)O

Isomeric SMILES

C1CC(=O)N(C1)[C@@H]2[C@H](CCOC3=CC=CC=C23)O

InChI

InChI=1S/C14H17NO3/c16-11-7-9-18-12-5-2-1-4-10(12)14(11)15-8-3-6-13(15)17/h1-2,4-5,11,14,16H,3,6-9H2/t11-,14-/m0/s1