tert-butyl 1-(2-methylpropyl)-3-phenyl-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl 1-(2-methylpropyl)-3-phenyl-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl 1-isobutyl-3-phenyl-1H-isoquinoline-2-carboxylate CAS Name: 1-(2-methylpropyl)-3-phenyl-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(2-methylpropyl)-3-phenyl-1H-isoquinoline-2-carboxylate Traditional Name: 1-isobutyl-3-phenyl-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C24H29NO2 MolecularWeight: 363.49256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C2=CC=CC=C2C=C(N1C(=O)OC(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CC(C)CC1C2=CC=CC=C2C=C(N1C(=O)OC(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C24H29NO2/c1-17(2)15-22-20-14-10-9-13-19(20)16-21(18-11-7-6-8-12-18)25(22)23(26)27-24(3,4)5/h6-14,16-17,22H,15H2,1-5H3