N-[(1R)-1-(3-bromanyl-4-methoxy-phenyl)ethyl]-4-(methylamino)-3-nitro-benzamide

Systemtic Name: N-[(1R)-1-(3-bromanyl-4-methoxy-phenyl)ethyl]-4-(methylamino)-3-nitro-benzamide Openeye Name: N-[(1R)-1-(3-bromo-4-methoxy-phenyl)ethyl]-4-(methylamino)-3-nitro-benzamide CAS Name: N-[(1R)-1-(3-bromo-4-methoxyphenyl)ethyl]-4-(methylamino)-3-nitrobenzamide IUPAC Name: N-[(1R)-1-(3-bromo-4-methoxyphenyl)ethyl]-4-(methylamino)-3-nitrobenzamide Traditional Name: N-[(1R)-1-(3-bromo-4-methoxy-phenyl)ethyl]-4-(methylamino)-3-nitro-benzamide Formula: C17H18BrN3O4 MolecularWeight: 408.24652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C1=CC(=C(C=C1)OC)Br)NC(=O)C2=CC(=C(C=C2)NC)[N+](=O)[O-]

InChI

InChI=1S/C17H18BrN3O4/c1-10(11-5-7-16(25-3)13(18)8-11)20-17(22)12-4-6-14(19-2)15(9-12)21(23)24/h4-10,19H,1-3H3,(H,20,22)/t10-/m1/s1