4-[[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]amino]-3-nitro-benzaldehyde

Systemtic Name: 4-[[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]amino]-3-nitro-benzaldehyde Openeye Name: 4-[[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]amino]-3-nitro-benzaldehyde CAS Name: 4-[[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]amino]-3-nitrobenzaldehyde IUPAC Name: 4-[[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]amino]-3-nitrobenzaldehyde Traditional Name: 4-[[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]amino]-3-nitro-benzaldehyde Formula: C17H18N2O4 MolecularWeight: 314.33582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C)NC2=C(C=C(C=C2)C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)[C@H](C)NC2=C(C=C(C=C2)C=O)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O4/c1-11-4-7-17(23-3)14(8-11)12(2)18-15-6-5-13(10-20)9-16(15)19(21)22/h4-10,12,18H,1-3H3/t12-/m0/s1