2-(3-nitrophenyl)-2-[(1R,6S)-8-oxidanylidene-7-azabicyclo[4.2.0]octan-7-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(3-nitrophenyl)-2-[(1R,6S)-8-oxidanylidene-7-azabicyclo[4.2.0]octan-7-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(3-nitrophenyl)-2-[(1R,6S)-8-oxo-7-azabicyclo[4.2.0]octan-7-yl]acetamide CAS Name: 2-(3-nitrophenyl)-2-[(1R,6S)-8-oxo-7-azabicyclo[4.2.0]octan-7-yl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(3-nitrophenyl)-2-[(1R,6S)-8-oxo-7-azabicyclo[4.2.0]octan-7-yl]acetamide Traditional Name: N-benzyl-2-[(1R,6S)-8-keto-7-azabicyclo[4.2.0]octan-7-yl]-2-(3-nitrophenyl)acetamide Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)C(=O)N2C(C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CC[C@H]2[C@@H](C1)C(=O)N2C(C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C22H23N3O4/c26-21(23-14-15-7-2-1-3-8-15)20(16-9-6-10-17(13-16)25(28)29)24-19-12-5-4-11-18(19)22(24)27/h1-3,6-10,13,18-20H,4-5,11-12,14H2,(H,23,26)/t18-,19+,20?/m1/s1