N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-4-(methylamino)-3-nitro-benzamide

Systemtic Name: N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-4-(methylamino)-3-nitro-benzamide Openeye Name: N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-4-(methylamino)-3-nitro-benzamide CAS Name: N-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]-4-(methylamino)-3-nitrobenzamide IUPAC Name: N-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]-4-(methylamino)-3-nitrobenzamide Traditional Name: N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-4-(methylamino)-3-nitro-benzamide Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C=C1)OC)[C@H](C)NC(=O)C2=CC(=C(C=C2)NC)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O4/c1-11-5-8-17(25-4)14(9-11)12(2)20-18(22)13-6-7-15(19-3)16(10-13)21(23)24/h5-10,12,19H,1-4H3,(H,20,22)/t12-/m0/s1