methyl 5-methyl-1-phenethyl-2-propyl-pyrrole-3-carboxylate

Systemtic Name: methyl 5-methyl-1-phenethyl-2-propyl-pyrrole-3-carboxylate Openeye Name: methyl 5-methyl-1-phenethyl-2-propyl-pyrrole-3-carboxylate CAS Name: 5-methyl-1-phenethyl-2-propyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-1-phenethyl-2-propylpyrrole-3-carboxylate Traditional Name: 5-methyl-1-phenethyl-2-propyl-pyrrole-3-carboxylic acid methyl ester Formula: C18H23NO2 MolecularWeight: 285.38072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(N1CCC2=CC=CC=C2)C)C(=O)OC

Isomeric SMILES

CCCC1=C(C=C(N1CCC2=CC=CC=C2)C)C(=O)OC

InChI

InChI=1S/C18H23NO2/c1-4-8-17-16(18(20)21-3)13-14(2)19(17)12-11-15-9-6-5-7-10-15/h5-7,9-10,13H,4,8,11-12H2,1-3H3