ethyl 4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]thiomorpholine-3-carboxylate

Systemtic Name: ethyl 4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]thiomorpholine-3-carboxylate Openeye Name: ethyl 4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]thiomorpholine-3-carboxylate CAS Name: 4-[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]-3-thiomorpholinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]thiomorpholine-3-carboxylate Traditional Name: 4-[(E)-3-(3-nitrophenyl)acryloyl]thiomorpholine-3-carboxylic acid ethyl ester Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSCCN1C(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CSCCN1C(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O5S/c1-2-23-16(20)14-11-24-9-8-17(14)15(19)7-6-12-4-3-5-13(10-12)18(21)22/h3-7,10,14H,2,8-9,11H2,1H3/b7-6+