2-[[3-methoxy-4-(pentanoylamino)phenyl]iminomethyl]-6-nitro-phenolate

Systemtic Name: 2-[[3-methoxy-4-(pentanoylamino)phenyl]iminomethyl]-6-nitro-phenolate Openeye Name: 2-[[3-methoxy-4-(pentanoylamino)phenyl]iminomethyl]-6-nitro-phenolate CAS Name: 2-[[3-methoxy-4-(1-oxopentylamino)phenyl]iminomethyl]-6-nitrophenolate IUPAC Name: 2-[[3-methoxy-4-(pentanoylamino)phenyl]iminomethyl]-6-nitrophenolate Traditional Name: 2-[[3-methoxy-4-(valerylamino)phenyl]iminomethyl]-6-nitro-phenolate Formula: C19H20N3O5- MolecularWeight: 370.3792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C(C=C1)N=CC2=C(C(=CC=C2)[N+](=O)[O-])[O-])OC

Isomeric SMILES

CCCCC(=O)NC1=C(C=C(C=C1)N=CC2=C(C(=CC=C2)[N+](=O)[O-])[O-])OC

InChI

InChI=1S/C19H21N3O5/c1-3-4-8-18(23)21-15-10-9-14(11-17(15)27-2)20-12-13-6-5-7-16(19(13)24)22(25)26/h5-7,9-12,24H,3-4,8H2,1-2H3,(H,21,23)/p-1