N-(5-chloranyl-2-methoxy-phenyl)-3-[4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)piperazin-1-yl]propanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-3-[4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)piperazin-1-yl]propanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-3-[4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-1-yl]propanamide CAS Name: N-(5-chloro-2-methoxyphenyl)-3-[4-[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]-1-piperazinyl]propanamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-3-[4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-1-yl]propanamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-3-[4-(2,3-dihydro-1,4-benzodioxin-3-carbonyl)piperazino]propionamide Formula: C23H26ClN3O5 MolecularWeight: 459.92264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CCN2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CCN2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C23H26ClN3O5/c1-30-18-7-6-16(24)14-17(18)25-22(28)8-9-26-10-12-27(13-11-26)23(29)21-15-31-19-4-2-3-5-20(19)32-21/h2-7,14,21H,8-13,15H2,1H3,(H,25,28)