(6-Benzyloxy-1H-indol-3-yl)-oxo-acetic acid methyl ester

HCID 34181007

Basic information

Standard SMILES
COC(=O)C(=O)c1c[nH]c2cc(OCc3ccccc3)ccc12
InChIKey
MIZNLOQJTYKTDH-UHFFFAOYSA-N
Molecular formula
C18H15NO4
Average molar mass
309.3 g/mol
Monoisotopic mass
309.10010796

Names & identifiers

Preferred name
(6-Benzyloxy-1H-indol-3-yl)-oxo-acetic acid methyl ester
IUPAC
methyl 2-oxo-2-(6-phenylmethoxy-1H-indol-3-yl)acetate

Names & synonyms

(6-Benzyloxy-1H-indol-3-yl)-oxo-acetic acid methyl esterMFCD09910223408355-02-2(6-benzyloxy-1H-indol-3-yl}-oxo-acetic acid methyl esterSCHEMBL2084401MIZNLOQJTYKTDH-UHFFFAOYSA-NB67488H54340methyl 2-(6-benzyloxy-1H-indol-3-yl)-2-oxo-acetatemethyl 2-oxo-2-(6-phenylmethoxy-1H-indol-3-yl)acetate

Database identifiers

PubChem CID
34181007

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
68.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
23

Related reactions

8 records

Linked notes

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