[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]methanone

Systemtic Name: [4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]methanone Openeye Name: [4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-[3-ethoxy-4-(4-pyridylmethoxy)phenyl]methanone CAS Name: [4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]methanone IUPAC Name: [4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]methanone Traditional Name: [4-(4-chloro-2-nitro-phenyl)piperazino]-[3-ethoxy-4-(4-pyridylmethoxy)phenyl]methanone Formula: C25H25ClN4O5 MolecularWeight: 496.9428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])OCC4=CC=NC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])OCC4=CC=NC=C4

InChI

InChI=1S/C25H25ClN4O5/c1-2-34-24-15-19(3-6-23(24)35-17-18-7-9-27-10-8-18)25(31)29-13-11-28(12-14-29)21-5-4-20(26)16-22(21)30(32)33/h3-10,15-16H,2,11-14,17H2,1H3