ethyl 5-ethenyl-4-(1-methoxyprop-2-ynyl)-1-(phenylmethyl)pyrrole-2-carboxylate

Systemtic Name: ethyl 5-ethenyl-4-(1-methoxyprop-2-ynyl)-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 1-benzyl-4-(1-methoxyprop-2-ynyl)-5-vinyl-pyrrole-2-carboxylate CAS Name: 5-ethenyl-4-(1-methoxyprop-2-ynyl)-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-5-ethenyl-4-(1-methoxyprop-2-ynyl)pyrrole-2-carboxylate Traditional Name: 1-benzyl-4-(1-methoxyprop-2-ynyl)-5-vinyl-pyrrole-2-carboxylic acid ethyl ester Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(N1CC2=CC=CC=C2)C=C)C(C#C)OC

Isomeric SMILES

CCOC(=O)C1=CC(=C(N1CC2=CC=CC=C2)C=C)C(C#C)OC

InChI

InChI=1S/C20H21NO3/c1-5-17-16(19(6-2)23-4)13-18(20(22)24-7-3)21(17)14-15-11-9-8-10-12-15/h2,5,8-13,19H,1,7,14H2,3-4H3