methyl 5-[4-(4-fluorophenyl)piperazin-1-yl]-2-(5-methyl-2-nitro-4-propan-2-yl-phenoxy)pentanoate

Systemtic Name: methyl 5-[4-(4-fluorophenyl)piperazin-1-yl]-2-(5-methyl-2-nitro-4-propan-2-yl-phenoxy)pentanoate Openeye Name: methyl 5-[4-(4-fluorophenyl)piperazin-1-yl]-2-(4-isopropyl-5-methyl-2-nitro-phenoxy)pentanoate CAS Name: 5-[4-(4-fluorophenyl)-1-piperazinyl]-2-(5-methyl-2-nitro-4-propan-2-ylphenoxy)pentanoic acid methyl ester IUPAC Name: methyl 5-[4-(4-fluorophenyl)piperazin-1-yl]-2-(5-methyl-2-nitro-4-propan-2-ylphenoxy)pentanoate Traditional Name: 5-[4-(4-fluorophenyl)piperazino]-2-(4-isopropyl-5-methyl-2-nitro-phenoxy)valeric acid methyl ester Formula: C26H34FN3O5 MolecularWeight: 487.563663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C)C)[N+](=O)[O-])OC(CCCN2CCN(CC2)C3=CC=C(C=C3)F)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1C(C)C)[N+](=O)[O-])OC(CCCN2CCN(CC2)C3=CC=C(C=C3)F)C(=O)OC

InChI

InChI=1S/C26H34FN3O5/c1-18(2)22-17-23(30(32)33)25(16-19(22)3)35-24(26(31)34-4)6-5-11-28-12-14-29(15-13-28)21-9-7-20(27)8-10-21/h7-10,16-18,24H,5-6,11-15H2,1-4H3