3-chloranyl-N-[3-chloranyl-4-[4-(4-propoxyphenyl)carbonylpiperazin-1-yl]phenyl]-4-ethoxy-benzamide

Systemtic Name: 3-chloranyl-N-[3-chloranyl-4-[4-(4-propoxyphenyl)carbonylpiperazin-1-yl]phenyl]-4-ethoxy-benzamide Openeye Name: 3-chloro-N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazin-1-yl]phenyl]-4-ethoxy-benzamide CAS Name: 3-chloro-N-[3-chloro-4-[4-[oxo-(4-propoxyphenyl)methyl]-1-piperazinyl]phenyl]-4-ethoxybenzamide IUPAC Name: 3-chloro-N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazin-1-yl]phenyl]-4-ethoxybenzamide Traditional Name: 3-chloro-N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazino]phenyl]-4-ethoxy-benzamide Formula: C29H31Cl2N3O4 MolecularWeight: 556.48014

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC(=C(C=C4)OCC)Cl)Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC(=C(C=C4)OCC)Cl)Cl

InChI

InChI=1S/C29H31Cl2N3O4/c1-3-17-38-23-9-5-20(6-10-23)29(36)34-15-13-33(14-16-34)26-11-8-22(19-24(26)30)32-28(35)21-7-12-27(37-4-2)25(31)18-21/h5-12,18-19H,3-4,13-17H2,1-2H3,(H,32,35)