ethyl 2-[3-[[4-(furan-3-yl)-2-nitro-phenyl]amino]phenyl]-2-piperazin-1-yl-ethanoate

Systemtic Name: ethyl 2-[3-[[4-(furan-3-yl)-2-nitro-phenyl]amino]phenyl]-2-piperazin-1-yl-ethanoate Openeye Name: ethyl 2-[3-[4-(3-furyl)-2-nitro-anilino]phenyl]-2-piperazin-1-yl-acetate CAS Name: 2-[3-[4-(3-furanyl)-2-nitroanilino]phenyl]-2-(1-piperazinyl)acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[4-(furan-3-yl)-2-nitroanilino]phenyl]-2-piperazin-1-ylacetate Traditional Name: 2-[3-[4-(3-furyl)-2-nitro-anilino]phenyl]-2-piperazino-acetic acid ethyl ester Formula: C24H26N4O5 MolecularWeight: 450.48704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC(=CC=C1)NC2=C(C=C(C=C2)C3=COC=C3)[N+](=O)[O-])N4CCNCC4

Isomeric SMILES

CCOC(=O)C(C1=CC(=CC=C1)NC2=C(C=C(C=C2)C3=COC=C3)[N+](=O)[O-])N4CCNCC4

InChI

InChI=1S/C24H26N4O5/c1-2-33-24(29)23(27-11-9-25-10-12-27)18-4-3-5-20(14-18)26-21-7-6-17(15-22(21)28(30)31)19-8-13-32-16-19/h3-8,13-16,23,25-26H,2,9-12H2,1H3