7-[methyl-[methyl-[2-(phenylsulfonyl)propyl]amino]amino]-2-oxidanylidene-chromene-3-carbaldehyde

Systemtic Name: 7-[methyl-[methyl-[2-(phenylsulfonyl)propyl]amino]amino]-2-oxidanylidene-chromene-3-carbaldehyde Openeye Name: 7-[[2-(benzenesulfonyl)propyl-methyl-amino]-methyl-amino]-2-oxo-chromene-3-carbaldehyde CAS Name: 7-[[2-(benzenesulfonyl)propyl-methylamino]-methylamino]-2-oxo-1-benzopyran-3-carboxaldehyde IUPAC Name: 7-[[2-(benzenesulfonyl)propyl-methylamino]-methylamino]-2-oxochromene-3-carbaldehyde Traditional Name: 7-[[2-besylpropyl(methyl)amino]-methyl-amino]-2-keto-chromene-3-carbaldehyde Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C)N(C)C1=CC2=C(C=C1)C=C(C(=O)O2)C=O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(CN(C)N(C)C1=CC2=C(C=C1)C=C(C(=O)O2)C=O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O5S/c1-15(29(26,27)19-7-5-4-6-8-19)13-22(2)23(3)18-10-9-16-11-17(14-24)21(25)28-20(16)12-18/h4-12,14-15H,13H2,1-3H3