2-(4-phenylpiperazin-1-yl)ethyl 1-(4-nitrophenyl)cyclopentane-1-carboxylate

Systemtic Name: 2-(4-phenylpiperazin-1-yl)ethyl 1-(4-nitrophenyl)cyclopentane-1-carboxylate Openeye Name: 2-(4-phenylpiperazin-1-yl)ethyl 1-(4-nitrophenyl)cyclopentanecarboxylate CAS Name: 1-(4-nitrophenyl)-1-cyclopentanecarboxylic acid 2-(4-phenyl-1-piperazinyl)ethyl ester IUPAC Name: 2-(4-phenylpiperazin-1-yl)ethyl 1-(4-nitrophenyl)cyclopentane-1-carboxylate Traditional Name: 1-(4-nitrophenyl)cyclopentanecarboxylic acid 2-(4-phenylpiperazino)ethyl ester Formula: C24H29N3O4 MolecularWeight: 423.50476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H29N3O4/c28-23(24(12-4-5-13-24)20-8-10-22(11-9-20)27(29)30)31-19-18-25-14-16-26(17-15-25)21-6-2-1-3-7-21/h1-3,6-11H,4-5,12-19H2