hexyl 4-[3-(3-nitrophenyl)prop-2-enoylamino]benzoate

Systemtic Name: hexyl 4-[3-(3-nitrophenyl)prop-2-enoylamino]benzoate Openeye Name: hexyl 4-[3-(3-nitrophenyl)prop-2-enoylamino]benzoate CAS Name: 4-[[3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[3-(3-nitrophenyl)prop-2-enoylamino]benzoate Traditional Name: 4-[[3-(3-nitrophenyl)acryloyl]amino]benzoic acid hexyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H24N2O5/c1-2-3-4-5-15-29-22(26)18-10-12-19(13-11-18)23-21(25)14-9-17-7-6-8-20(16-17)24(27)28/h6-14,16H,2-5,15H2,1H3,(H,23,25)