methyl 3-[(3-chlorophenyl)methyl-methyl-carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[(3-chlorophenyl)methyl-methyl-carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(3-chlorophenyl)methyl-methyl-carbamoyl]-5-nitro-benzoate CAS Name: 3-[[(3-chlorophenyl)methyl-methylamino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(3-chlorophenyl)methyl-methylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[(3-chlorobenzyl)-methyl-carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C17H15ClN2O5 MolecularWeight: 362.7644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)Cl)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CN(CC1=CC(=CC=C1)Cl)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C17H15ClN2O5/c1-19(10-11-4-3-5-14(18)6-11)16(21)12-7-13(17(22)25-2)9-15(8-12)20(23)24/h3-9H,10H2,1-2H3