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ethyl 3-nitro-5-(4-phenylpiperazin-1-yl)carbonyl-benzoate

ethyl 3-nitro-5-(4-phenylpiperazin-1-yl)carbonyl-benzoate

Systemtic Name:ethyl 3-nitro-5-(4-phenylpiperazin-1-yl)carbonyl-benzoate
Openeye Name:ethyl 3-nitro-5-(4-phenylpiperazine-1-carbonyl)benzoate
CAS Name:3-nitro-5-[oxo-(4-phenyl-1-piperazinyl)methyl]benzoic acid ethyl ester
IUPAC Name:ethyl 3-nitro-5-(4-phenylpiperazine-1-carbonyl)benzoate
Traditional Name:3-nitro-5-(4-phenylpiperazine-1-carbonyl)benzoic acid ethyl ester
Formula: C20H21N3O5
MolecularWeight: 383.39784
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)[N+](=O)[O-]


Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)[N+](=O)[O-]


InChI

InChI=1S/C20H21N3O5/c1-2-28-20(25)16-12-15(13-18(14-16)23(26)27)19(24)22-10-8-21(9-11-22)17-6-4-3-5-7-17/h3-7,12-14H,2,8-11H2,1H3


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