(4-Nitrophenyl)6-phenylmethoxycarbonylaminohexanoate

HCID 295489
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
59188-41-9
Standard SMILES
O=C(CCCCCNC(=O)OCc1ccccc1)Oc1ccc([N+](=O)[O-])cc1
InChIKey
SGVLCRQVULHBAR-UHFFFAOYSA-N
Molecular formula
C20H22N2O6
Average molar mass
386.4 g/mol
Monoisotopic mass
386.14778642

Names & identifiers

Preferred name
(4-Nitrophenyl)6-phenylmethoxycarbonylaminohexanoate
IUPAC
(4-nitrophenyl) 6-(phenylmethoxycarbonylamino)hexanoate

Names & synonyms

59188-41-9(4-nitrophenyl)6-phenylmethoxycarbonylaminohexanoateNSC164667SCHEMBL9345671DTXSID90304221SGVLCRQVULHBAR-UHFFFAOYSA-NNSC-1646674-nitrophenyl 6-{[(benzyloxy)carbonyl]amino}hexanoateN-benzyloxycarbonyl-6-aminohexanoic acid p-nitrophenyl ester

Database identifiers

CAS
59188-41-9
PubChem CID
295489
DTXSID
DTXSID90304221

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
110 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
28

Related reactions

4 records
New reaction record

Compound notes

Loading…