4-methylsulfonyl-6-(piperazin-1-ylmethyl)-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 4-methylsulfonyl-6-(piperazin-1-ylmethyl)-2,3-dihydro-1,4-benzoxazine Openeye Name: 4-methylsulfonyl-6-(piperazin-1-ylmethyl)-2,3-dihydro-1,4-benzoxazine CAS Name: 4-methylsulfonyl-6-(1-piperazinylmethyl)-2,3-dihydro-1,4-benzoxazine IUPAC Name: 4-methylsulfonyl-6-(piperazin-1-ylmethyl)-2,3-dihydro-1,4-benzoxazine Traditional Name: 4-mesyl-6-(piperazinomethyl)-2,3-dihydro-1,4-benzoxazine Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCOC2=C1C=C(C=C2)CN3CCNCC3

Isomeric SMILES

CS(=O)(=O)N1CCOC2=C1C=C(C=C2)CN3CCNCC3

InChI

InChI=1S/C14H21N3O3S/c1-21(18,19)17-8-9-20-14-3-2-12(10-13(14)17)11-16-6-4-15-5-7-16/h2-3,10,15H,4-9,11H2,1H3