methyl 4-[[4-(naphthalen-2-ylcarbamoyl)-2-nitro-phenyl]amino]butanoate

Systemtic Name: methyl 4-[[4-(naphthalen-2-ylcarbamoyl)-2-nitro-phenyl]amino]butanoate Openeye Name: methyl 4-[4-(2-naphthylcarbamoyl)-2-nitro-anilino]butanoate CAS Name: 4-[4-[(2-naphthalenylamino)-oxomethyl]-2-nitroanilino]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(naphthalen-2-ylcarbamoyl)-2-nitroanilino]butanoate Traditional Name: 4-[4-(2-naphthylcarbamoyl)-2-nitro-anilino]butyric acid methyl ester Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC1=C(C=C(C=C1)C(=O)NC2=CC3=CC=CC=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCCNC1=C(C=C(C=C1)C(=O)NC2=CC3=CC=CC=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O5/c1-30-21(26)7-4-12-23-19-11-9-17(14-20(19)25(28)29)22(27)24-18-10-8-15-5-2-3-6-16(15)13-18/h2-3,5-6,8-11,13-14,23H,4,7,12H2,1H3,(H,24,27)