methyl 5-(1-adamantylmethylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-(1-adamantylmethylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-(1-adamantylmethylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(1-adamantylmethylamino)-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(1-adamantylmethylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-(1-adamantylmethylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C20H28N2O3 MolecularWeight: 344.44792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H28N2O3/c1-11-16(19(24)25-3)12(2)22-17(11)18(23)21-10-20-7-13-4-14(8-20)6-15(5-13)9-20/h13-15,22H,4-10H2,1-3H3,(H,21,23)