Name: tert-butyl 6-(3-methoxy-3-oxoprop-1-enyl)-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate

SMILES: CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)C3=C(O2)C=CC(=C3)C=CC(=O)OC

Molecular Processing

Molecular formula

C22H27NO6

Molecular weight

401.46

Exact mass

401.1838

XLogP

3.61

TPSA

82.14

H-bond donors

H-bond acceptors

Rotatable bonds

Heavy atoms

Rings

Aromatic rings

Saturated rings

Aliphatic rings

Stereo centers

Undefined stereo

Formal charge

Heteroatoms

Covalent units

Fraction Csp3

0.5

Molar refractivity

106.84

Supplementary Information

InChIKey: SIAVOOUDCWMFSO-UHFFFAOYSA-N

Synonyme

SCHEMBL1175945