tert-butyl 4-[3-methoxy-5-[(2-oxidanylidene-3,4-dihydroquinolin-1-yl)methyl]phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-methoxy-5-[(2-oxidanylidene-3,4-dihydroquinolin-1-yl)methyl]phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-methoxy-5-[(2-oxo-3,4-dihydroquinolin-1-yl)methyl]phenyl]piperazine-1-carboxylate CAS Name: 4-[3-methoxy-5-[(2-oxo-3,4-dihydroquinolin-1-yl)methyl]phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-methoxy-5-[(2-oxo-3,4-dihydroquinolin-1-yl)methyl]phenyl]piperazine-1-carboxylate Traditional Name: 4-[3-[(2-keto-3,4-dihydroquinolin-1-yl)methyl]-5-methoxy-phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=CC(=C2)CN3C(=O)CCC4=CC=CC=C43)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=CC(=C2)CN3C(=O)CCC4=CC=CC=C43)OC

InChI

InChI=1S/C26H33N3O4/c1-26(2,3)33-25(31)28-13-11-27(12-14-28)21-15-19(16-22(17-21)32-4)18-29-23-8-6-5-7-20(23)9-10-24(29)30/h5-8,15-17H,9-14,18H2,1-4H3