methyl (3R)-2-[2-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]oxyethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl (3R)-2-[2-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]oxyethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3R)-2-[2-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[2-[(E)-3-(3-methoxyphenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-2-[2-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-[2-[(E)-3-(3-methoxyphenyl)acryloyl]oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C23H23NO6 MolecularWeight: 409.43182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=CC(=O)OCC(=O)N2CC3=CC=CC=C3CC2C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)/C=C/C(=O)OCC(=O)N2CC3=CC=CC=C3C[C@@H]2C(=O)OC

InChI

InChI=1S/C23H23NO6/c1-28-19-9-5-6-16(12-19)10-11-22(26)30-15-21(25)24-14-18-8-4-3-7-17(18)13-20(24)23(27)29-2/h3-12,20H,13-15H2,1-2H3/b11-10+/t20-/m1/s1