methyl 4-[4-aminocarbonyl-1-(2,3-dihydro-1H-inden-1-yl)-5-methyl-2-pentyl-pyrrol-3-yl]benzoate

Systemtic Name: methyl 4-[4-aminocarbonyl-1-(2,3-dihydro-1H-inden-1-yl)-5-methyl-2-pentyl-pyrrol-3-yl]benzoate Openeye Name: methyl 4-(4-carbamoyl-1-indan-1-yl-5-methyl-2-pentyl-pyrrol-3-yl)benzoate CAS Name: 4-[4-carbamoyl-1-(2,3-dihydro-1H-inden-1-yl)-5-methyl-2-pentyl-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-carbamoyl-1-(2,3-dihydro-1H-inden-1-yl)-5-methyl-2-pentylpyrrol-3-yl]benzoate Traditional Name: 4-(2-amyl-4-carbamoyl-1-indan-1-yl-5-methyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C28H32N2O3 MolecularWeight: 444.56528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1C2CCC3=CC=CC=C23)C)C(=O)N)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CCCCCC1=C(C(=C(N1C2CCC3=CC=CC=C23)C)C(=O)N)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C28H32N2O3/c1-4-5-6-11-24-26(20-12-14-21(15-13-20)28(32)33-3)25(27(29)31)18(2)30(24)23-17-16-19-9-7-8-10-22(19)23/h7-10,12-15,23H,4-6,11,16-17H2,1-3H3,(H2,29,31)