methyl 4-(4-aminocarbonyl-5-methyl-1-prop-2-enyl-2-propyl-pyrrol-3-yl)benzoate

Systemtic Name: methyl 4-(4-aminocarbonyl-5-methyl-1-prop-2-enyl-2-propyl-pyrrol-3-yl)benzoate Openeye Name: methyl 4-(1-allyl-4-carbamoyl-5-methyl-2-propyl-pyrrol-3-yl)benzoate CAS Name: 4-(4-carbamoyl-5-methyl-1-prop-2-enyl-2-propyl-3-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-carbamoyl-5-methyl-1-prop-2-enyl-2-propylpyrrol-3-yl)benzoate Traditional Name: 4-(1-allyl-4-carbamoyl-5-methyl-2-propyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C20H24N2O3 MolecularWeight: 340.41616

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(N1CC=C)C)C(=O)N)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCC1=C(C(=C(N1CC=C)C)C(=O)N)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C20H24N2O3/c1-5-7-16-18(14-8-10-15(11-9-14)20(24)25-4)17(19(21)23)13(3)22(16)12-6-2/h6,8-11H,2,5,7,12H2,1,3-4H3,(H2,21,23)