[2-[4-(2,5-dimethylpyrrol-1-yl)phenyl]prop-2-enoyl-methyl-amino] ethanoate

Systemtic Name: [2-[4-(2,5-dimethylpyrrol-1-yl)phenyl]prop-2-enoyl-methyl-amino] ethanoate Openeye Name: [2-[4-(2,5-dimethylpyrrol-1-yl)phenyl]prop-2-enoyl-methyl-amino] acetate CAS Name: acetic acid [[2-[4-(2,5-dimethyl-1-pyrrolyl)phenyl]-1-oxoprop-2-enyl]-methylamino] ester IUPAC Name: [2-[4-(2,5-dimethylpyrrol-1-yl)phenyl]prop-2-enoyl-methylamino] acetate Traditional Name: acetic acid [[2-[4-(2,5-dimethylpyrrol-1-yl)phenyl]acryloyl]-methyl-amino] ester Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=C)C(=O)N(C)OC(=O)C)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=C)C(=O)N(C)OC(=O)C)C

InChI

InChI=1S/C18H20N2O3/c1-12-6-7-13(2)20(12)17-10-8-16(9-11-17)14(3)18(22)19(5)23-15(4)21/h6-11H,3H2,1-2,4-5H3