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

Systemtic Name: methyl 4-(4-aminocarbonyl-1-cyclooctyl-2,5-dimethyl-pyrrol-3-yl)benzoate Openeye Name: methyl 4-(4-carbamoyl-1-cyclooctyl-2,5-dimethyl-pyrrol-3-yl)benzoate CAS Name: 4-(4-carbamoyl-1-cyclooctyl-2,5-dimethyl-3-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-carbamoyl-1-cyclooctyl-2,5-dimethylpyrrol-3-yl)benzoate Traditional Name: 4-(4-carbamoyl-1-cyclooctyl-2,5-dimethyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C2CCCCCCC2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(N1C2CCCCCCC2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H30N2O3/c1-15-20(17-11-13-18(14-12-17)23(27)28-3)21(22(24)26)16(2)25(15)19-9-7-5-4-6-8-10-19/h11-14,19H,4-10H2,1-3H3,(H2,24,26)