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

Systemtic Name: (E)-2-acetamido-3-[3-methoxy-4-[(3-nitrophenyl)methoxy]phenyl]prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-[3-methoxy-4-[(3-nitrophenyl)methoxy]phenyl]prop-2-enoic acid CAS Name: (E)-2-acetamido-3-[3-methoxy-4-[(3-nitrophenyl)methoxy]phenyl]-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-[3-methoxy-4-[(3-nitrophenyl)methoxy]phenyl]prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-[3-methoxy-4-(3-nitrobenzyl)oxy-phenyl]acrylic acid Formula: C19H18N2O7 MolecularWeight: 386.35542

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=CC1=CC(=C(C=C1)OCC2=CC(=CC=C2)[N+](=O)[O-])OC)C(=O)O

Isomeric SMILES

CC(=O)N/C(=C/C1=CC(=C(C=C1)OCC2=CC(=CC=C2)[N+](=O)[O-])OC)/C(=O)O

InChI

InChI=1S/C19H18N2O7/c1-12(22)20-16(19(23)24)9-13-6-7-17(18(10-13)27-2)28-11-14-4-3-5-15(8-14)21(25)26/h3-10H,11H2,1-2H3,(H,20,22)(H,23,24)/b16-9+