ethyl 5-oxidanyl-3-oxidanylidene-7-[2,2,4-trimethyl-5-[methyl-(phenylmethyl)amino]-6-propan-2-yl-3H-1-benzofuran-7-yl]heptanoate

Systemtic Name: ethyl 5-oxidanyl-3-oxidanylidene-7-[2,2,4-trimethyl-5-[methyl-(phenylmethyl)amino]-6-propan-2-yl-3H-1-benzofuran-7-yl]heptanoate Openeye Name: ethyl 7-[5-[benzyl(methyl)amino]-6-isopropyl-2,2,4-trimethyl-3H-benzofuran-7-yl]-5-hydroxy-3-oxo-heptanoate CAS Name: 5-hydroxy-3-oxo-7-[2,2,4-trimethyl-5-[methyl-(phenylmethyl)amino]-6-propan-2-yl-3H-benzofuran-7-yl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[5-[benzyl(methyl)amino]-2,2,4-trimethyl-6-propan-2-yl-3H-1-benzofuran-7-yl]-5-hydroxy-3-oxoheptanoate Traditional Name: 7-[5-[benzyl(methyl)amino]-6-isopropyl-2,2,4-trimethyl-coumaran-7-yl]-5-hydroxy-3-keto-enanthic acid ethyl ester Formula: C31H43NO5 MolecularWeight: 509.67682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CC(CCC1=C2C(=C(C(=C1C(C)C)N(C)CC3=CC=CC=C3)C)CC(O2)(C)C)O

Isomeric SMILES

CCOC(=O)CC(=O)CC(CCC1=C2C(=C(C(=C1C(C)C)N(C)CC3=CC=CC=C3)C)CC(O2)(C)C)O

InChI

InChI=1S/C31H43NO5/c1-8-36-27(35)17-24(34)16-23(33)14-15-25-28(20(2)3)29(32(7)19-22-12-10-9-11-13-22)21(4)26-18-31(5,6)37-30(25)26/h9-13,20,23,33H,8,14-19H2,1-7H3