methyl 2-[[[(E)-3-(4-nitrophenyl)prop-2-enoyl]-propyl-amino]methyl]-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 2-[[[(E)-3-(4-nitrophenyl)prop-2-enoyl]-propyl-amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[[(E)-3-(4-nitrophenyl)prop-2-enoyl]-propyl-amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]-propylamino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[[(E)-3-(4-nitrophenyl)prop-2-enoyl]-propylamino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[[(E)-3-(4-nitrophenyl)acryloyl]-propyl-amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C18H19N3O6 MolecularWeight: 373.35996

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=CO1)C(=O)OC)C(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC1=NC(=CO1)C(=O)OC)C(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O6/c1-3-10-20(11-16-19-15(12-27-16)18(23)26-2)17(22)9-6-13-4-7-14(8-5-13)21(24)25/h4-9,12H,3,10-11H2,1-2H3/b9-6+