3,4-bis(bromanyl)-6-methoxy-2-[[3-methoxy-4-(pentanoylamino)phenyl]iminomethyl]phenolate

Systemtic Name: 3,4-bis(bromanyl)-6-methoxy-2-[[3-methoxy-4-(pentanoylamino)phenyl]iminomethyl]phenolate Openeye Name: 3,4-dibromo-6-methoxy-2-[[3-methoxy-4-(pentanoylamino)phenyl]iminomethyl]phenolate CAS Name: 3,4-dibromo-6-methoxy-2-[[3-methoxy-4-(1-oxopentylamino)phenyl]iminomethyl]phenolate IUPAC Name: 3,4-dibromo-6-methoxy-2-[[3-methoxy-4-(pentanoylamino)phenyl]iminomethyl]phenolate Traditional Name: 3,4-dibromo-6-methoxy-2-[[3-methoxy-4-(valerylamino)phenyl]iminomethyl]phenolate Formula: C20H21Br2N2O4- MolecularWeight: 513.19974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C(C=C1)N=CC2=C(C(=CC(=C2Br)Br)OC)[O-])OC

Isomeric SMILES

CCCCC(=O)NC1=C(C=C(C=C1)N=CC2=C(C(=CC(=C2Br)Br)OC)[O-])OC

InChI

InChI=1S/C20H22Br2N2O4/c1-4-5-6-18(25)24-15-8-7-12(9-16(15)27-2)23-11-13-19(22)14(21)10-17(28-3)20(13)26/h7-11,26H,4-6H2,1-3H3,(H,24,25)/p-1