4-[[1-(4-methylphenyl)-2-morpholin-4-yl-ethyl]amino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[[1-(4-methylphenyl)-2-morpholin-4-yl-ethyl]amino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[[2-morpholino-1-(p-tolyl)ethyl]amino]-3-nitro-benzonitrile CAS Name: 4-[[1-(4-methylphenyl)-2-(4-morpholinyl)ethyl]amino]-3-nitrobenzonitrile IUPAC Name: 4-[[1-(4-methylphenyl)-2-morpholin-4-ylethyl]amino]-3-nitrobenzonitrile Traditional Name: 4-[[2-morpholino-1-(p-tolyl)ethyl]amino]-3-nitro-benzonitrile Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CN2CCOCC2)NC3=C(C=C(C=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(CN2CCOCC2)NC3=C(C=C(C=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O3/c1-15-2-5-17(6-3-15)19(14-23-8-10-27-11-9-23)22-18-7-4-16(13-21)12-20(18)24(25)26/h2-7,12,19,22H,8-11,14H2,1H3