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(E)-2-acetamido-3-[3-ethoxy-4-[(3-nitrophenyl)methoxy]phenyl]prop-2-enoic acid
(E)-2-acetamido-3-[3-ethoxy-4-[(3-nitrophenyl)methoxy]phenyl]prop-2-enoic acid
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Descriptors Computed from Structure
Canonical SMILES:
CCOC1=C(C=CC(=C1)C=C(C(=O)O)NC(=O)C)OCC2=CC(=CC=C2)[N+](=O)[O-]
Isomeric SMILES
CCOC1=C(C=CC(=C1)/C=C(\C(=O)O)/NC(=O)C)OCC2=CC(=CC=C2)[N+](=O)[O-]
InChI
InChI=1S/C20H20N2O7/c1-3-28-19-11-14(10-17(20(24)25)21-13(2)23)7-8-18(19)29-12-15-5-4-6-16(9-15)22(26)27/h4-11H,3,12H2,1-2H3,(H,21,23)(H,24,25)/b17-10+
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