tert-butyl (E)-3-[6,7-dimethoxy-3-(2-methoxyphenyl)isoquinolin-4-yl]prop-2-enoate

Systemtic Name: tert-butyl (E)-3-[6,7-dimethoxy-3-(2-methoxyphenyl)isoquinolin-4-yl]prop-2-enoate Openeye Name: tert-butyl (E)-3-[6,7-dimethoxy-3-(2-methoxyphenyl)-4-isoquinolyl]prop-2-enoate CAS Name: (E)-3-[6,7-dimethoxy-3-(2-methoxyphenyl)-4-isoquinolinyl]-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-[6,7-dimethoxy-3-(2-methoxyphenyl)isoquinolin-4-yl]prop-2-enoate Traditional Name: (E)-3-[6,7-dimethoxy-3-(2-methoxyphenyl)-4-isoquinolyl]acrylic acid tert-butyl ester Formula: C25H27NO5 MolecularWeight: 421.48558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CC1=C(N=CC2=CC(=C(C=C21)OC)OC)C3=CC=CC=C3OC

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/C1=C(N=CC2=CC(=C(C=C21)OC)OC)C3=CC=CC=C3OC

InChI

InChI=1S/C25H27NO5/c1-25(2,3)31-23(27)12-11-17-19-14-22(30-6)21(29-5)13-16(19)15-26-24(17)18-9-7-8-10-20(18)28-4/h7-15H,1-6H3/b12-11+