5-[bis(prop-2-enyl)amino]-2-nitro-benzoate

Systemtic Name: 5-[bis(prop-2-enyl)amino]-2-nitro-benzoate Openeye Name: 5-(diallylamino)-2-nitro-benzoate CAS Name: 5-[bis(prop-2-enyl)amino]-2-nitrobenzoate IUPAC Name: 5-[bis(prop-2-enyl)amino]-2-nitrobenzoate Traditional Name: 5-(diallylamino)-2-nitro-benzoate Formula: C13H13N2O4- MolecularWeight: 261.25332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O4/c1-3-7-14(8-4-2)10-5-6-12(15(18)19)11(9-10)13(16)17/h3-6,9H,1-2,7-8H2,(H,16,17)/p-1