3-nitro-4-(4-propylpiperazin-1-yl)benzoic acid

Systemtic Name: 3-nitro-4-(4-propylpiperazin-1-yl)benzoic acid Openeye Name: 3-nitro-4-(4-propylpiperazin-1-yl)benzoic acid CAS Name: 3-nitro-4-(4-propyl-1-piperazinyl)benzoic acid IUPAC Name: 3-nitro-4-(4-propylpiperazin-1-yl)benzoic acid Traditional Name: 3-nitro-4-(4-propylpiperazino)benzoic acid Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O4/c1-2-5-15-6-8-16(9-7-15)12-4-3-11(14(18)19)10-13(12)17(20)21/h3-4,10H,2,5-9H2,1H3,(H,18,19)