4-[[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]amino]-3-nitro-benzaldehyde

Systemtic Name: 4-[[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]amino]-3-nitro-benzaldehyde Openeye Name: 4-[[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]amino]-3-nitro-benzaldehyde CAS Name: 4-[[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]amino]-3-nitrobenzaldehyde IUPAC Name: 4-[[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]amino]-3-nitrobenzaldehyde Traditional Name: 4-[[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]amino]-3-nitro-benzaldehyde Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC1=C(C=C(C=C1)C=O)[N+](=O)[O-])C2=CC(=CC=C2)OC

Isomeric SMILES

CN(C)[C@H](CNC1=C(C=C(C=C1)C=O)[N+](=O)[O-])C2=CC(=CC=C2)OC

InChI

InChI=1S/C18H21N3O4/c1-20(2)18(14-5-4-6-15(10-14)25-3)11-19-16-8-7-13(12-22)9-17(16)21(23)24/h4-10,12,18-19H,11H2,1-3H3/t18-/m1/s1