N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-phenylpiperazin-1-yl)-2-pyridin-3-yl-ethyl]ethanediamide

Systemtic Name: N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-phenylpiperazin-1-yl)-2-pyridin-3-yl-ethyl]ethanediamide Openeye Name: N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-phenylpiperazin-1-yl)-2-(3-pyridyl)ethyl]oxamide CAS Name: N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-phenyl-1-piperazinyl)-2-(3-pyridinyl)ethyl]oxamide IUPAC Name: N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-phenylpiperazin-1-yl)-2-pyridin-3-ylethyl]oxamide Traditional Name: N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-phenylpiperazino)-2-(3-pyridyl)ethyl]oxamide Formula: C27H29N5O4 MolecularWeight: 487.55026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(CNC(=O)C(=O)NC3=CC4=C(C=C3)OCCO4)C5=CN=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(CNC(=O)C(=O)NC3=CC4=C(C=C3)OCCO4)C5=CN=CC=C5

InChI

InChI=1S/C27H29N5O4/c33-26(27(34)30-21-8-9-24-25(17-21)36-16-15-35-24)29-19-23(20-5-4-10-28-18-20)32-13-11-31(12-14-32)22-6-2-1-3-7-22/h1-10,17-18,23H,11-16,19H2,(H,29,33)(H,30,34)