methyl 3-[4-(3-methylbutoxy)-3-naphthalen-2-yl-5-nitro-phenyl]propanoate

Systemtic Name: methyl 3-[4-(3-methylbutoxy)-3-naphthalen-2-yl-5-nitro-phenyl]propanoate Openeye Name: methyl 3-[4-isopentyloxy-3-(2-naphthyl)-5-nitro-phenyl]propanoate CAS Name: 3-[4-(3-methylbutoxy)-3-(2-naphthalenyl)-5-nitrophenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(3-methylbutoxy)-3-naphthalen-2-yl-5-nitrophenyl]propanoate Traditional Name: 3-[4-isoamoxy-3-(2-naphthyl)-5-nitro-phenyl]propionic acid methyl ester Formula: C25H27NO5 MolecularWeight: 421.48558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1C2=CC3=CC=CC=C3C=C2)CCC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1C2=CC3=CC=CC=C3C=C2)CCC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C25H27NO5/c1-17(2)12-13-31-25-22(21-10-9-19-6-4-5-7-20(19)16-21)14-18(8-11-24(27)30-3)15-23(25)26(28)29/h4-7,9-10,14-17H,8,11-13H2,1-3H3