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

Systemtic Name: methyl 4-(4-aminocarbonyl-2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)benzoate Openeye Name: methyl 4-(1-allyl-4-carbamoyl-2,5-dimethyl-pyrrol-3-yl)benzoate CAS Name: 4-(4-carbamoyl-2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-carbamoyl-2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)benzoate Traditional Name: 4-(1-allyl-4-carbamoyl-2,5-dimethyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC=C)C)C(=O)N)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(N1CC=C)C)C(=O)N)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H20N2O3/c1-5-10-20-11(2)15(16(12(20)3)17(19)21)13-6-8-14(9-7-13)18(22)23-4/h5-9H,1,10H2,2-4H3,(H2,19,21)