tert-butyl 5-[(Z)-4-aminocarbonyl-6-(4-chlorophenyl)selanyl-3-methyl-hex-3-en-1-ynyl]-3-(3-methoxy-3-oxidanylidene-propyl)-4-methyl-1H-pyrrole-2-carboxylate

Systemtic Name: tert-butyl 5-[(Z)-4-aminocarbonyl-6-(4-chlorophenyl)selanyl-3-methyl-hex-3-en-1-ynyl]-3-(3-methoxy-3-oxidanylidene-propyl)-4-methyl-1H-pyrrole-2-carboxylate Openeye Name: tert-butyl 5-[(Z)-4-carbamoyl-6-(4-chlorophenyl)selanyl-3-methyl-hex-3-en-1-ynyl]-3-(3-methoxy-3-oxo-propyl)-4-methyl-1H-pyrrole-2-carboxylate CAS Name: 5-[(Z)-4-carbamoyl-6-[(4-chlorophenyl)seleno]-3-methylhex-3-en-1-ynyl]-3-(3-methoxy-3-oxopropyl)-4-methyl-1H-pyrrole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[(Z)-4-carbamoyl-6-(4-chlorophenyl)selanyl-3-methylhex-3-en-1-ynyl]-3-(3-methoxy-3-oxopropyl)-4-methyl-1H-pyrrole-2-carboxylate Traditional Name: 5-[(Z)-4-carbamoyl-6-[(4-chlorophenyl)seleno]-3-methyl-hex-3-en-1-ynyl]-3-(3-keto-3-methoxy-propyl)-4-methyl-1H-pyrrole-2-carboxylic acid tert-butyl ester Formula: C28H33ClN2O5Se MolecularWeight: 591.98502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1CCC(=O)OC)C(=O)OC(C)(C)C)C#CC(=C(CC[Se]C2=CC=C(C=C2)Cl)C(=O)N)C

Isomeric SMILES

CC1=C(NC(=C1CCC(=O)OC)C(=O)OC(C)(C)C)C#C/C(=C(/CC[Se]C2=CC=C(C=C2)Cl)\C(=O)N)/C

InChI

InChI=1S/C28H33ClN2O5Se/c1-17(21(26(30)33)15-16-37-20-10-8-19(29)9-11-20)7-13-23-18(2)22(12-14-24(32)35-6)25(31-23)27(34)36-28(3,4)5/h8-11,31H,12,14-16H2,1-6H3,(H2,30,33)/b21-17-