4-[methyl-[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]butanoic acid

Systemtic Name: 4-[methyl-[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]butanoic acid Openeye Name: 4-[methyl-[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]butanoic acid CAS Name: 4-[methyl-[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 4-[methyl-[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]butanoic acid Traditional Name: 4-[methyl-[(E)-3-(3-nitrophenyl)acryloyl]amino]butyric acid Formula: C14H16N2O5 MolecularWeight: 292.28724

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)C=CC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CN(CCCC(=O)O)C(=O)/C=C/C1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O5/c1-15(9-3-6-14(18)19)13(17)8-7-11-4-2-5-12(10-11)16(20)21/h2,4-5,7-8,10H,3,6,9H2,1H3,(H,18,19)/b8-7+