4-[[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]carbonyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]carbonyl]piperazine-1-carbaldehyde Openeye Name: 4-[4-(p-tolylsulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carbonyl]piperazine-1-carbaldehyde CAS Name: 4-[[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-oxomethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl]piperazine-1-carbaldehyde Traditional Name: 4-(4-tosyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)piperazine-1-carbaldehyde Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(OC3=CC=CC=C32)C(=O)N4CCN(CC4)C=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(OC3=CC=CC=C32)C(=O)N4CCN(CC4)C=O

InChI

InChI=1S/C21H23N3O5S/c1-16-6-8-17(9-7-16)30(27,28)24-14-20(29-19-5-3-2-4-18(19)24)21(26)23-12-10-22(15-25)11-13-23/h2-9,15,20H,10-14H2,1H3