3-[3-chloranyl-4-[(3-nitrophenyl)methoxy]phenyl]prop-2-enoic acid

Systemtic Name: 3-[3-chloranyl-4-[(3-nitrophenyl)methoxy]phenyl]prop-2-enoic acid Openeye Name: 3-[3-chloro-4-[(3-nitrophenyl)methoxy]phenyl]prop-2-enoic acid CAS Name: 3-[3-chloro-4-[(3-nitrophenyl)methoxy]phenyl]-2-propenoic acid IUPAC Name: 3-[3-chloro-4-[(3-nitrophenyl)methoxy]phenyl]prop-2-enoic acid Traditional Name: 3-[3-chloro-4-(3-nitrobenzyl)oxy-phenyl]acrylic acid Formula: C16H12ClNO5 MolecularWeight: 333.72318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])COC2=C(C=C(C=C2)C=CC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])COC2=C(C=C(C=C2)C=CC(=O)O)Cl

InChI

InChI=1S/C16H12ClNO5/c17-14-9-11(5-7-16(19)20)4-6-15(14)23-10-12-2-1-3-13(8-12)18(21)22/h1-9H,10H2,(H,19,20)