1-(2-chloranyl-4-nitro-phenyl)carbonyl-2,3,4,5-tetrahydro-1-benzazocin-6-one

Systemtic Name: 1-(2-chloranyl-4-nitro-phenyl)carbonyl-2,3,4,5-tetrahydro-1-benzazocin-6-one Openeye Name: 1-(2-chloro-4-nitro-benzoyl)-2,3,4,5-tetrahydro-1-benzazocin-6-one CAS Name: 1-[(2-chloro-4-nitrophenyl)-oxomethyl]-2,3,4,5-tetrahydro-1-benzazocin-6-one IUPAC Name: 1-(2-chloro-4-nitrobenzoyl)-2,3,4,5-tetrahydro-1-benzazocin-6-one Traditional Name: 1-(2-chloro-4-nitro-benzoyl)-2,3,4,5-tetrahydro-1-benzazocin-6-one Formula: C18H15ClN2O4 MolecularWeight: 358.7757

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C2=CC=CC=C2C(=O)C1)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(C2=CC=CC=C2C(=O)C1)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H15ClN2O4/c19-15-11-12(21(24)25)8-9-13(15)18(23)20-10-4-3-7-17(22)14-5-1-2-6-16(14)20/h1-2,5-6,8-9,11H,3-4,7,10H2