N-(2-hydroxyethyl)-4-[(1-methyl-4-oxidanyl-4-propan-2-yl-cyclohex-2-en-1-yl)-oxidanyl-amino]-3-nitro-benzamide

Systemtic Name: N-(2-hydroxyethyl)-4-[(1-methyl-4-oxidanyl-4-propan-2-yl-cyclohex-2-en-1-yl)-oxidanyl-amino]-3-nitro-benzamide Openeye Name: N-(2-hydroxyethyl)-4-[hydroxy-(4-hydroxy-4-isopropyl-1-methyl-cyclohex-2-en-1-yl)amino]-3-nitro-benzamide CAS Name: N-(2-hydroxyethyl)-4-[hydroxy-(4-hydroxy-1-methyl-4-propan-2-yl-1-cyclohex-2-enyl)amino]-3-nitrobenzamide IUPAC Name: N-(2-hydroxyethyl)-4-[hydroxy-(4-hydroxy-1-methyl-4-propan-2-ylcyclohex-2-en-1-yl)amino]-3-nitrobenzamide Traditional Name: N-(2-hydroxyethyl)-4-[hydroxy-(4-hydroxy-4-isopropyl-1-methyl-cyclohex-2-en-1-yl)amino]-3-nitro-benzamide Formula: C19H27N3O6 MolecularWeight: 393.43418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CCC(C=C1)(C)N(C2=C(C=C(C=C2)C(=O)NCCO)[N+](=O)[O-])O)O

Isomeric SMILES

CC(C)C1(CCC(C=C1)(C)N(C2=C(C=C(C=C2)C(=O)NCCO)[N+](=O)[O-])O)O

InChI

InChI=1S/C19H27N3O6/c1-13(2)19(25)8-6-18(3,7-9-19)21(26)15-5-4-14(12-16(15)22(27)28)17(24)20-10-11-23/h4-6,8,12-13,23,25-26H,7,9-11H2,1-3H3,(H,20,24)