ethyl 1-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxidanylidene-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxidanylidene-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxo-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 1-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxopropyl]-2-methyl-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxopropyl]-2-methyl-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[3-(homoveratrylamino)-3-keto-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCC(=O)NCCC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCC(=O)NCCC3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C27H32N2O5/c1-5-34-27(31)22-18-23(21-9-7-6-8-10-21)29(19(22)2)16-14-26(30)28-15-13-20-11-12-24(32-3)25(17-20)33-4/h6-12,17-18H,5,13-16H2,1-4H3,(H,28,30)