methyl 4-[(1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl)amino]-3-nitro-benzoate

Systemtic Name: methyl 4-[(1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl)amino]-3-nitro-benzoate Openeye Name: methyl 4-[(1-methoxycarbonyl-3-methyl-butyl)amino]-3-nitro-benzoate CAS Name: 4-[(1-methoxy-4-methyl-1-oxopentan-2-yl)amino]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[(1-methoxy-4-methyl-1-oxopentan-2-yl)amino]-3-nitrobenzoate Traditional Name: 4-[(1-carbomethoxy-3-methyl-butyl)amino]-3-nitro-benzoic acid methyl ester Formula: C15H20N2O6 MolecularWeight: 324.3291

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(C(=O)OC)NC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O6/c1-9(2)7-12(15(19)23-4)16-11-6-5-10(14(18)22-3)8-13(11)17(20)21/h5-6,8-9,12,16H,7H2,1-4H3