1-ethyl-7-nitro-5-phenyl-spiro[1,4-benzodiazepine-3,4'-piperidine]-2-one

Systemtic Name: 1-ethyl-7-nitro-5-phenyl-spiro[1,4-benzodiazepine-3,4'-piperidine]-2-one Openeye Name: 1-ethyl-7-nitro-5-phenyl-spiro[1,4-benzodiazepine-3,4'-piperidine]-2-one CAS Name: 1-ethyl-7-nitro-5-phenyl-2-spiro[1,4-benzodiazepine-3,4'-piperidine]one IUPAC Name: 1-ethyl-7-nitro-5-phenylspiro[1,4-benzodiazepine-3,4'-piperidine]-2-one Traditional Name: 1-ethyl-7-nitro-5-phenyl-spiro[1,4-benzodiazepine-3,4'-piperidine]-2-one Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=NC3(C1=O)CCNCC3)C4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=NC3(C1=O)CCNCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O3/c1-2-24-18-9-8-16(25(27)28)14-17(18)19(15-6-4-3-5-7-15)23-21(20(24)26)10-12-22-13-11-21/h3-9,14,22H,2,10-13H2,1H3