CC1(C2=C(C=CC(=C2)O)C(=O)C3=C1NC4=C3C=CC(=C4)C#N)C
이름: 8-hydroxy-6,6-dimethyl-11-oxo-5H-benzo[b]carbazole-3-carbonitrile
SMILES: CC1(C2=C(C=CC(=C2)O)C(=O)C3=C1NC4=C3C=CC(=C4)C#N)C

Molecular Processing

Molecular formula
C19H14N2O2
Molecular weight
302.33
Exact mass
302.1055
XLogP
3.62
TPSA
76.88
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
23
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.158
Molar refractivity
86.68

Supplementary Information

InChIKey: AMPWXZFRDSJWSN-UHFFFAOYSA-N
동의어
SCHEMBL896554AMPWXZFRDSJWSN-UHFFFAOYSA-N8-Hydroxy-6,6-dimethyl-11-oxo-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile
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