(phenylmethyl) 2-azanyl-4-(4-nitrophenoxy)butanoate

Systemtic Name: (phenylmethyl) 2-azanyl-4-(4-nitrophenoxy)butanoate Openeye Name: benzyl 2-amino-4-(4-nitrophenoxy)butanoate CAS Name: 2-amino-4-(4-nitrophenoxy)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-amino-4-(4-nitrophenoxy)butanoate Traditional Name: 2-amino-4-(4-nitrophenoxy)butyric acid benzyl ester Formula: C17H18N2O5 MolecularWeight: 330.33522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CCOC2=CC=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CCOC2=CC=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C17H18N2O5/c18-16(17(20)24-12-13-4-2-1-3-5-13)10-11-23-15-8-6-14(7-9-15)19(21)22/h1-9,16H,10-12,18H2