tert-butyl 4-[(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)ethanoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)ethanoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetyl]piperidine-1-carboxylate CAS Name: 4-[(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-oxoethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetyl]piperidine-1-carboxylate Traditional Name: 4-[(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=CC(=O)C3CCN(CC3)C(=O)OC(C)(C)C)N1)C

Isomeric SMILES

CC1(CC2=CC=CC=C2/C(=C/C(=O)C3CCN(CC3)C(=O)OC(C)(C)C)/N1)C

InChI

InChI=1S/C23H32N2O3/c1-22(2,3)28-21(27)25-12-10-16(11-13-25)20(26)14-19-18-9-7-6-8-17(18)15-23(4,5)24-19/h6-9,14,16,24H,10-13,15H2,1-5H3/b19-14-