4-[[(2-chloranyl-4-nitro-phenyl)-methyl-amino]methyl]-N-cyclopropyl-benzamide

Systemtic Name: 4-[[(2-chloranyl-4-nitro-phenyl)-methyl-amino]methyl]-N-cyclopropyl-benzamide Openeye Name: 4-[(2-chloro-N-methyl-4-nitro-anilino)methyl]-N-cyclopropyl-benzamide CAS Name: 4-[(2-chloro-N-methyl-4-nitroanilino)methyl]-N-cyclopropylbenzamide IUPAC Name: 4-[(2-chloro-N-methyl-4-nitroanilino)methyl]-N-cyclopropylbenzamide Traditional Name: 4-[(2-chloro-N-methyl-4-nitro-anilino)methyl]-N-cyclopropyl-benzamide Formula: C18H18ClN3O3 MolecularWeight: 359.80682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)NC2CC2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)NC2CC2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H18ClN3O3/c1-21(17-9-8-15(22(24)25)10-16(17)19)11-12-2-4-13(5-3-12)18(23)20-14-6-7-14/h2-5,8-10,14H,6-7,11H2,1H3,(H,20,23)