tert-butyl 3-phenyl-1-propan-2-yl-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl 3-phenyl-1-propan-2-yl-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl 1-isopropyl-3-phenyl-1H-isoquinoline-2-carboxylate CAS Name: 3-phenyl-1-propan-2-yl-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-phenyl-1-propan-2-yl-1H-isoquinoline-2-carboxylate Traditional Name: 1-isopropyl-3-phenyl-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C23H27NO2 MolecularWeight: 349.46598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C2=CC=CC=C2C=C(N1C(=O)OC(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1C2=CC=CC=C2C=C(N1C(=O)OC(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C23H27NO2/c1-16(2)21-19-14-10-9-13-18(19)15-20(17-11-7-6-8-12-17)24(21)22(25)26-23(3,4)5/h6-16,21H,1-5H3