3-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]-N-(2-nitrophenyl)propanamide

Systemtic Name: 3-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]-N-(2-nitrophenyl)propanamide Openeye Name: 3-[(5-bromo-2-methoxy-phenyl)methyl-methyl-amino]-N-(2-nitrophenyl)propanamide CAS Name: 3-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-N-(2-nitrophenyl)propanamide IUPAC Name: 3-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-N-(2-nitrophenyl)propanamide Traditional Name: 3-[(5-bromo-2-methoxy-benzyl)-methyl-amino]-N-(2-nitrophenyl)propionamide Formula: C18H20BrN3O4 MolecularWeight: 422.2731

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)NC1=CC=CC=C1[N+](=O)[O-])CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CN(CCC(=O)NC1=CC=CC=C1[N+](=O)[O-])CC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C18H20BrN3O4/c1-21(12-13-11-14(19)7-8-17(13)26-2)10-9-18(23)20-15-5-3-4-6-16(15)22(24)25/h3-8,11H,9-10,12H2,1-2H3,(H,20,23)