methyl 3-[4-[4-[[(2-methyl-3-nitro-phenyl)amino]methyl]phenoxy]phenyl]propanoate

Systemtic Name: methyl 3-[4-[4-[[(2-methyl-3-nitro-phenyl)amino]methyl]phenoxy]phenyl]propanoate Openeye Name: methyl 3-[4-[4-[(2-methyl-3-nitro-anilino)methyl]phenoxy]phenyl]propanoate CAS Name: 3-[4-[4-[(2-methyl-3-nitroanilino)methyl]phenoxy]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[4-[(2-methyl-3-nitroanilino)methyl]phenoxy]phenyl]propanoate Traditional Name: 3-[4-[4-[(2-methyl-3-nitro-anilino)methyl]phenoxy]phenyl]propionic acid methyl ester Formula: C24H24N2O5 MolecularWeight: 420.45776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NCC2=CC=C(C=C2)OC3=CC=C(C=C3)CCC(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NCC2=CC=C(C=C2)OC3=CC=C(C=C3)CCC(=O)OC

InChI

InChI=1S/C24H24N2O5/c1-17-22(4-3-5-23(17)26(28)29)25-16-19-8-13-21(14-9-19)31-20-11-6-18(7-12-20)10-15-24(27)30-2/h3-9,11-14,25H,10,15-16H2,1-2H3