[4-(ethylcarbamoyl)-2-nitro-phenyl] pentanoate

Systemtic Name: [4-(ethylcarbamoyl)-2-nitro-phenyl] pentanoate Openeye Name: [4-(ethylcarbamoyl)-2-nitro-phenyl] pentanoate CAS Name: pentanoic acid [4-(ethylcarbamoyl)-2-nitrophenyl] ester IUPAC Name: [4-(ethylcarbamoyl)-2-nitrophenyl] pentanoate Traditional Name: valeric acid [4-(ethylcarbamoyl)-2-nitro-phenyl] ester Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=C(C=C(C=C1)C(=O)NCC)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)OC1=C(C=C(C=C1)C(=O)NCC)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O5/c1-3-5-6-13(17)21-12-8-7-10(14(18)15-4-2)9-11(12)16(19)20/h7-9H,3-6H2,1-2H3,(H,15,18)