methyl (3S)-3-(2-nitrophenyl)pentanoate

Systemtic Name: methyl (3S)-3-(2-nitrophenyl)pentanoate Openeye Name: methyl (3S)-3-(2-nitrophenyl)pentanoate CAS Name: (3S)-3-(2-nitrophenyl)pentanoic acid methyl ester IUPAC Name: methyl (3S)-3-(2-nitrophenyl)pentanoate Traditional Name: (3S)-3-(2-nitrophenyl)valeric acid methyl ester Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@@H](CC(=O)OC)C1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C12H15NO4/c1-3-9(8-12(14)17-2)10-6-4-5-7-11(10)13(15)16/h4-7,9H,3,8H2,1-2H3/t9-/m0/s1