[(E)-[azanyl-(3-nitrophenyl)methylidene]amino] 4-propoxybenzoate

Systemtic Name: [(E)-[azanyl-(3-nitrophenyl)methylidene]amino] 4-propoxybenzoate Openeye Name: [(E)-[amino-(3-nitrophenyl)methylene]amino] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [(E)-[amino-(3-nitrophenyl)methylidene]amino] ester IUPAC Name: [(E)-[amino-(3-nitrophenyl)methylidene]amino] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [(E)-[amino-(3-nitrophenyl)methylene]amino] ester Formula: C17H17N3O5 MolecularWeight: 343.33398

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)ON=C(C2=CC(=CC=C2)[N+](=O)[O-])N

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)O/N=C(\C2=CC(=CC=C2)[N+](=O)[O-])/N

InChI

InChI=1S/C17H17N3O5/c1-2-10-24-15-8-6-12(7-9-15)17(21)25-19-16(18)13-4-3-5-14(11-13)20(22)23/h3-9,11H,2,10H2,1H3,(H2,18,19)