methyl 4-[[methyl-[1-(3-nitrophenyl)ethyl]amino]methyl]benzoate

Systemtic Name: methyl 4-[[methyl-[1-(3-nitrophenyl)ethyl]amino]methyl]benzoate Openeye Name: methyl 4-[[methyl-[1-(3-nitrophenyl)ethyl]amino]methyl]benzoate CAS Name: 4-[[methyl-[1-(3-nitrophenyl)ethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[methyl-[1-(3-nitrophenyl)ethyl]amino]methyl]benzoate Traditional Name: 4-[[methyl-[1-(3-nitrophenyl)ethyl]amino]methyl]benzoic acid methyl ester Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)CC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H20N2O4/c1-13(16-5-4-6-17(11-16)20(22)23)19(2)12-14-7-9-15(10-8-14)18(21)24-3/h4-11,13H,12H2,1-3H3