4-(4-methyl-2-thiophen-2-yl-1,3-dioxan-2-yl)-2-nitro-aniline

Systemtic Name: 4-(4-methyl-2-thiophen-2-yl-1,3-dioxan-2-yl)-2-nitro-aniline Openeye Name: 4-[4-methyl-2-(2-thienyl)-1,3-dioxan-2-yl]-2-nitro-aniline CAS Name: 4-(4-methyl-2-thiophen-2-yl-1,3-dioxan-2-yl)-2-nitroaniline IUPAC Name: 4-(4-methyl-2-thiophen-2-yl-1,3-dioxan-2-yl)-2-nitroaniline Traditional Name: [4-[4-methyl-2-(2-thienyl)-1,3-dioxan-2-yl]-2-nitro-phenyl]amine Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCOC(O1)(C2=CC(=C(C=C2)N)[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

CC1CCOC(O1)(C2=CC(=C(C=C2)N)[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C15H16N2O4S/c1-10-6-7-20-15(21-10,14-3-2-8-22-14)11-4-5-12(16)13(9-11)17(18)19/h2-5,8-10H,6-7,16H2,1H3