tert-butyl 7-azanyl-1-cyclopentyl-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl 7-azanyl-1-cyclopentyl-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl 7-amino-1-cyclopentyl-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 7-amino-1-cyclopentyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-amino-1-cyclopentyl-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 7-amino-1-cyclopentyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C19H28N2O2 MolecularWeight: 316.43782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(C1C3CCCC3)C=C(C=C2)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(C1C3CCCC3)C=C(C=C2)N

InChI

InChI=1S/C19H28N2O2/c1-19(2,3)23-18(22)21-11-10-13-8-9-15(20)12-16(13)17(21)14-6-4-5-7-14/h8-9,12,14,17H,4-7,10-11,20H2,1-3H3