propan-2-yl 5-(1-adamantylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: propan-2-yl 5-(1-adamantylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: isopropyl 5-(1-adamantylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(1-adamantylamino)-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-(1-adamantylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-(1-adamantylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid isopropyl ester Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H30N2O3/c1-11(2)26-20(25)17-12(3)18(22-13(17)4)19(24)23-21-8-14-5-15(9-21)7-16(6-14)10-21/h11,14-16,22H,5-10H2,1-4H3,(H,23,24)