CCCCC1c2cc(C(=O)O)ccc2CCN1C(=O)OC(C)(C)C
Name: 2-(tert-butoxycarbonyl)-1-butyl-1,2,3,4-tetrahydroisoquinoline-7-carboxylic acid
SMILES: CCCCC1c2cc(C(=O)O)ccc2CCN1C(=O)OC(C)(C)C

Molecular Processing

Molecular formula
C19H27NO4
Molecular weight
333.43
Exact mass
333.194
XLogP
4.41
TPSA
66.84
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.579
Molar refractivity
92.31

Supplementary Information

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Involved in 5 reactions→

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