carboxy-[[2-[ethyl(methyl)amino]-5-nitro-phenyl]methyl]carbamic acid

Systemtic Name: carboxy-[[2-[ethyl(methyl)amino]-5-nitro-phenyl]methyl]carbamic acid Openeye Name: carboxy-[[2-[ethyl(methyl)amino]-5-nitro-phenyl]methyl]carbamic acid CAS Name: carboxy-[[2-[ethyl(methyl)amino]-5-nitrophenyl]methyl]carbamic acid IUPAC Name: carboxy-[[2-[ethyl(methyl)amino]-5-nitrophenyl]methyl]carbamic acid Traditional Name: carboxy-[2-[ethyl(methyl)amino]-5-nitro-benzyl]carbamic acid Formula: C12H15N3O6 MolecularWeight: 297.264

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C1=C(C=C(C=C1)[N+](=O)[O-])CN(C(=O)O)C(=O)O

Isomeric SMILES

CCN(C)C1=C(C=C(C=C1)[N+](=O)[O-])CN(C(=O)O)C(=O)O

InChI

InChI=1S/C12H15N3O6/c1-3-13(2)10-5-4-9(15(20)21)6-8(10)7-14(11(16)17)12(18)19/h4-6H,3,7H2,1-2H3,(H,16,17)(H,18,19)