methyl 3-[4-aminocarbonyl-1-(1,3-benzodioxol-5-ylmethyl)-5-methyl-3-phenyl-pyrrol-2-yl]propanoate

Systemtic Name: methyl 3-[4-aminocarbonyl-1-(1,3-benzodioxol-5-ylmethyl)-5-methyl-3-phenyl-pyrrol-2-yl]propanoate Openeye Name: methyl 3-[1-(1,3-benzodioxol-5-ylmethyl)-4-carbamoyl-5-methyl-3-phenyl-pyrrol-2-yl]propanoate CAS Name: 3-[1-(1,3-benzodioxol-5-ylmethyl)-4-carbamoyl-5-methyl-3-phenyl-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-(1,3-benzodioxol-5-ylmethyl)-4-carbamoyl-5-methyl-3-phenylpyrrol-2-yl]propanoate Traditional Name: 3-(4-carbamoyl-5-methyl-3-phenyl-1-piperonyl-pyrrol-2-yl)propionic acid methyl ester Formula: C24H24N2O5 MolecularWeight: 420.45776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC3=C(C=C2)OCO3)CCC(=O)OC)C4=CC=CC=C4)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC3=C(C=C2)OCO3)CCC(=O)OC)C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C24H24N2O5/c1-15-22(24(25)28)23(17-6-4-3-5-7-17)18(9-11-21(27)29-2)26(15)13-16-8-10-19-20(12-16)31-14-30-19/h3-8,10,12H,9,11,13-14H2,1-2H3,(H2,25,28)