methyl 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methanoyl-2-methyl-4-(4-propan-2-ylphenyl)pyrrole-3-carboxylate

Systemtic Name: methyl 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methanoyl-2-methyl-4-(4-propan-2-ylphenyl)pyrrole-3-carboxylate Openeye Name: methyl 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-formyl-4-(4-isopropylphenyl)-2-methyl-pyrrole-3-carboxylate CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-formyl-2-methyl-4-(4-propan-2-ylphenyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-formyl-2-methyl-4-(4-propan-2-ylphenyl)pyrrole-3-carboxylate Traditional Name: 5-formyl-1-homoveratryl-2-methyl-4-p-cumenyl-pyrrole-3-carboxylic acid methyl ester Formula: C27H31NO5 MolecularWeight: 449.53874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CCC2=CC(=C(C=C2)OC)OC)C=O)C3=CC=C(C=C3)C(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(N1CCC2=CC(=C(C=C2)OC)OC)C=O)C3=CC=C(C=C3)C(C)C)C(=O)OC

InChI

InChI=1S/C27H31NO5/c1-17(2)20-8-10-21(11-9-20)26-22(16-29)28(18(3)25(26)27(30)33-6)14-13-19-7-12-23(31-4)24(15-19)32-5/h7-12,15-17H,13-14H2,1-6H3