(E)-2-benzamido-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoic acid

Systemtic Name: (E)-2-benzamido-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoic acid Openeye Name: (E)-2-benzamido-3-(4-chloro-3-nitro-phenyl)prop-2-enoic acid CAS Name: (E)-2-benzamido-3-(4-chloro-3-nitrophenyl)-2-propenoic acid IUPAC Name: (E)-2-benzamido-3-(4-chloro-3-nitrophenyl)prop-2-enoic acid Traditional Name: (E)-2-benzamido-3-(4-chloro-3-nitro-phenyl)acrylic acid Formula: C16H11ClN2O5 MolecularWeight: 346.72194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/C(=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-])/C(=O)O

InChI

InChI=1S/C16H11ClN2O5/c17-12-7-6-10(9-14(12)19(23)24)8-13(16(21)22)18-15(20)11-4-2-1-3-5-11/h1-9H,(H,18,20)(H,21,22)/b13-8+