(2,6-ditert-butyl-4-methoxy-phenyl) (2E,3S)-2-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imino-3,6-dimethyl-hept-5-enoate

Systemtic Name: (2,6-ditert-butyl-4-methoxy-phenyl) (2E,3S)-2-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imino-3,6-dimethyl-hept-5-enoate Openeye Name: (2,6-ditert-butyl-4-methoxy-phenyl) (2E,3S)-2-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imino-3,6-dimethyl-hept-5-enoate CAS Name: (2E,3S)-2-[[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]imino]-3,6-dimethyl-5-heptenoic acid (2,6-ditert-butyl-4-methoxyphenyl) ester IUPAC Name: (2,6-ditert-butyl-4-methoxyphenyl) (2E,3S)-2-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imino-3,6-dimethylhept-5-enoate Traditional Name: (2E,3S)-2-[(2S)-2-(methoxymethyl)pyrrolidino]imino-3,6-dimethyl-hept-5-enoic acid (2,6-ditert-butyl-4-methoxy-phenyl) ester Formula: C30H48N2O4 MolecularWeight: 500.71312

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=C(C)C)C(=NN1CCCC1COC)C(=O)OC2=C(C=C(C=C2C(C)(C)C)OC)C(C)(C)C

Isomeric SMILES

C[C@@H](CC=C(C)C)/C(=N\N1CCC[C@H]1COC)/C(=O)OC2=C(C=C(C=C2C(C)(C)C)OC)C(C)(C)C

InChI

InChI=1S/C30H48N2O4/c1-20(2)14-15-21(3)26(31-32-16-12-13-22(32)19-34-10)28(33)36-27-24(29(4,5)6)17-23(35-11)18-25(27)30(7,8)9/h14,17-18,21-22H,12-13,15-16,19H2,1-11H3/b31-26+/t21-,22-/m0/s1