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

Systemtic Name: methyl 4-(4-aminocarbonyl-2,5-dimethyl-1-undecyl-pyrrol-3-yl)benzoate Openeye Name: methyl 4-(4-carbamoyl-2,5-dimethyl-1-undecyl-pyrrol-3-yl)benzoate CAS Name: 4-(4-carbamoyl-2,5-dimethyl-1-undecyl-3-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-carbamoyl-2,5-dimethyl-1-undecylpyrrol-3-yl)benzoate Traditional Name: 4-(4-carbamoyl-2,5-dimethyl-1-undecyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C26H38N2O3 MolecularWeight: 426.59152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCN1C(=C(C(=C1C)C(=O)N)C2=CC=C(C=C2)C(=O)OC)C

Isomeric SMILES

CCCCCCCCCCCN1C(=C(C(=C1C)C(=O)N)C2=CC=C(C=C2)C(=O)OC)C

InChI

InChI=1S/C26H38N2O3/c1-5-6-7-8-9-10-11-12-13-18-28-19(2)23(24(20(28)3)25(27)29)21-14-16-22(17-15-21)26(30)31-4/h14-17H,5-13,18H2,1-4H3,(H2,27,29)