(2Z)-2-(nitromethylidene)-1-prop-2-enyl-1,3-diazepane

Systemtic Name: (2Z)-2-(nitromethylidene)-1-prop-2-enyl-1,3-diazepane Openeye Name: (2Z)-1-allyl-2-(nitromethylene)-1,3-diazepane CAS Name: (2Z)-2-(nitromethylidene)-1-prop-2-enyl-1,3-diazepane IUPAC Name: (2Z)-2-(nitromethylidene)-1-prop-2-enyl-1,3-diazepane Traditional Name: (2Z)-1-allyl-2-(nitromethylene)-1,3-diazepane Formula: C9H15N3O2 MolecularWeight: 197.2343

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCCCNC1=C[N+](=O)[O-]

Isomeric SMILES

C=CCN\1CCCCN/C1=C/[N+](=O)[O-]

InChI

InChI=1S/C9H15N3O2/c1-2-6-11-7-4-3-5-10-9(11)8-12(13)14/h2,8,10H,1,3-7H2/b9-8-