[4-(2-nitrophenyl)sulfonyl-2-(3,4,5-trimethoxyphenyl)pyridin-3-yl]methanamine

Systemtic Name: [4-(2-nitrophenyl)sulfonyl-2-(3,4,5-trimethoxyphenyl)pyridin-3-yl]methanamine Openeye Name: [4-(2-nitrophenyl)sulfonyl-2-(3,4,5-trimethoxyphenyl)-3-pyridyl]methanamine CAS Name: [4-(2-nitrophenyl)sulfonyl-2-(3,4,5-trimethoxyphenyl)-3-pyridinyl]methanamine IUPAC Name: [4-(2-nitrophenyl)sulfonyl-2-(3,4,5-trimethoxyphenyl)pyridin-3-yl]methanamine Traditional Name: [4-(2-nitrophenyl)sulfonyl-2-(3,4,5-trimethoxyphenyl)-3-pyridyl]methylamine Formula: C21H21N3O7S MolecularWeight: 459.47234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC=CC(=C2CN)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC=CC(=C2CN)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O7S/c1-29-16-10-13(11-17(30-2)21(16)31-3)20-14(12-22)18(8-9-23-20)32(27,28)19-7-5-4-6-15(19)24(25)26/h4-11H,12,22H2,1-3H3