[3,8-diacetyloxy-1-cyano-6-methyl-4-propan-2-yl-7-(1,6,7-triacetyloxy-8-cyano-3-methyl-5-propan-2-yl-naphthalen-2-yl)naphthalen-2-yl] ethanoate

Systemtic Name: [3,8-diacetyloxy-1-cyano-6-methyl-4-propan-2-yl-7-(1,6,7-triacetyloxy-8-cyano-3-methyl-5-propan-2-yl-naphthalen-2-yl)naphthalen-2-yl] ethanoate Openeye Name: [3,8-diacetoxy-1-cyano-4-isopropyl-6-methyl-7-(1,6,7-triacetoxy-8-cyano-5-isopropyl-3-methyl-2-naphthyl)-2-naphthyl] acetate CAS Name: acetic acid [3,8-diacetyloxy-1-cyano-6-methyl-4-propan-2-yl-7-(1,6,7-triacetyloxy-8-cyano-3-methyl-5-propan-2-yl-2-naphthalenyl)-2-naphthalenyl] ester IUPAC Name: [3,8-diacetyloxy-1-cyano-6-methyl-4-propan-2-yl-7-(1,6,7-triacetyloxy-8-cyano-3-methyl-5-propan-2-ylnaphthalen-2-yl)naphthalen-2-yl] acetate Traditional Name: acetic acid [3,8-diacetoxy-1-cyano-4-isopropyl-6-methyl-7-(1,6,7-triacetoxy-8-cyano-5-isopropyl-3-methyl-2-naphthyl)-2-naphthyl] ester Formula: C42H40N2O12 MolecularWeight: 764.7732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C1)C(=C(C(=C2C#N)OC(=O)C)OC(=O)C)C(C)C)OC(=O)C)C3=C(C=C4C(=C3OC(=O)C)C(=C(C(=C4C(C)C)OC(=O)C)OC(=O)C)C#N)C

Isomeric SMILES

CC1=C(C(=C2C(=C1)C(=C(C(=C2C#N)OC(=O)C)OC(=O)C)C(C)C)OC(=O)C)C3=C(C=C4C(=C3OC(=O)C)C(=C(C(=C4C(C)C)OC(=O)C)OC(=O)C)C#N)C

InChI

InChI=1S/C42H40N2O12/c1-17(2)31-27-13-19(5)33(39(53-23(9)47)35(27)29(15-43)37(51-21(7)45)41(31)55-25(11)49)34-20(6)14-28-32(18(3)4)42(56-26(12)50)38(52-22(8)46)30(16-44)36(28)40(34)54-24(10)48/h13-14,17-18H,1-12H3