methyl 2-(1-benzamidoethyl)-3-methyl-4-nitro-butanoate

Systemtic Name: methyl 2-(1-benzamidoethyl)-3-methyl-4-nitro-butanoate Openeye Name: methyl 2-(1-benzamidoethyl)-3-methyl-4-nitro-butanoate CAS Name: 2-(1-benzamidoethyl)-3-methyl-4-nitrobutanoic acid methyl ester IUPAC Name: methyl 2-(1-benzamidoethyl)-3-methyl-4-nitrobutanoate Traditional Name: 2-(1-benzamidoethyl)-3-methyl-4-nitro-butyric acid methyl ester Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O5/c1-10(9-17(20)21)13(15(19)22-3)11(2)16-14(18)12-7-5-4-6-8-12/h4-8,10-11,13H,9H2,1-3H3,(H,16,18)