tert-butyl 5-(3-methoxyphenyl)-4-nitro-pentanoate

Systemtic Name: tert-butyl 5-(3-methoxyphenyl)-4-nitro-pentanoate Openeye Name: tert-butyl 5-(3-methoxyphenyl)-4-nitro-pentanoate CAS Name: 5-(3-methoxyphenyl)-4-nitropentanoic acid tert-butyl ester IUPAC Name: tert-butyl 5-(3-methoxyphenyl)-4-nitropentanoate Traditional Name: 5-(3-methoxyphenyl)-4-nitro-valeric acid tert-butyl ester Formula: C16H23NO5 MolecularWeight: 309.35752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(CC1=CC(=CC=C1)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)CCC(CC1=CC(=CC=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H23NO5/c1-16(2,3)22-15(18)9-8-13(17(19)20)10-12-6-5-7-14(11-12)21-4/h5-7,11,13H,8-10H2,1-4H3