N-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-N-(phenylmethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-N-(phenylmethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-benzyl-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-N-(phenylmethyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-benzyl-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-benzyl-N-[2-keto-2-(4-phenylpiperazino)ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C27H29N3O5S MolecularWeight: 507.60126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CN(CC3=CC=CC=C3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CN(CC3=CC=CC=C3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C27H29N3O5S/c31-27(29-15-13-28(14-16-29)23-9-5-2-6-10-23)21-30(20-22-7-3-1-4-8-22)36(32,33)24-11-12-25-26(19-24)35-18-17-34-25/h1-12,19H,13-18,20-21H2