prop-2-enyl 1-(tert-butylcarbamoyl)-1H-isoquinoline-2-carboxylate

Systemtic Name: prop-2-enyl 1-(tert-butylcarbamoyl)-1H-isoquinoline-2-carboxylate Openeye Name: allyl 1-(tert-butylcarbamoyl)-1H-isoquinoline-2-carboxylate CAS Name: 1-[(tert-butylamino)-oxomethyl]-1H-isoquinoline-2-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 1-(tert-butylcarbamoyl)-1H-isoquinoline-2-carboxylate Traditional Name: 1-(tert-butylcarbamoyl)-1H-isoquinoline-2-carboxylic acid allyl ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1C2=CC=CC=C2C=CN1C(=O)OCC=C

Isomeric SMILES

CC(C)(C)NC(=O)C1C2=CC=CC=C2C=CN1C(=O)OCC=C

InChI

InChI=1S/C18H22N2O3/c1-5-12-23-17(22)20-11-10-13-8-6-7-9-14(13)15(20)16(21)19-18(2,3)4/h5-11,15H,1,12H2,2-4H3,(H,19,21)