1-butyl-4-ethenyl-3-(4-nitrophenyl)-1,3-diazepan-2-one

Systemtic Name: 1-butyl-4-ethenyl-3-(4-nitrophenyl)-1,3-diazepan-2-one Openeye Name: 1-butyl-3-(4-nitrophenyl)-4-vinyl-1,3-diazepan-2-one CAS Name: 1-butyl-4-ethenyl-3-(4-nitrophenyl)-1,3-diazepan-2-one IUPAC Name: 1-butyl-4-ethenyl-3-(4-nitrophenyl)-1,3-diazepan-2-one Traditional Name: 1-butyl-3-(4-nitrophenyl)-4-vinyl-1,3-diazepan-2-one Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCC(N(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C=C

Isomeric SMILES

CCCCN1CCCC(N(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C=C

InChI

InChI=1S/C17H23N3O3/c1-3-5-12-18-13-6-7-14(4-2)19(17(18)21)15-8-10-16(11-9-15)20(22)23/h4,8-11,14H,2-3,5-7,12-13H2,1H3