methyl 3-nitro-4-(4-propylpiperazin-1-yl)benzoate

Systemtic Name: methyl 3-nitro-4-(4-propylpiperazin-1-yl)benzoate Openeye Name: methyl 3-nitro-4-(4-propylpiperazin-1-yl)benzoate CAS Name: 3-nitro-4-(4-propyl-1-piperazinyl)benzoic acid methyl ester IUPAC Name: methyl 3-nitro-4-(4-propylpiperazin-1-yl)benzoate Traditional Name: 3-nitro-4-(4-propylpiperazino)benzoic acid methyl ester Formula: C15H21N3O4 MolecularWeight: 307.34494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O4/c1-3-6-16-7-9-17(10-8-16)13-5-4-12(15(19)22-2)11-14(13)18(20)21/h4-5,11H,3,6-10H2,1-2H3