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(E)-3-[4-(diethylamino)phenyl]prop-2-enoic acid hydrate

(E)-3-[4-(diethylamino)phenyl]prop-2-enoic acid hydrate

Systemtic Name:(E)-3-[4-(diethylamino)phenyl]prop-2-enoic acid hydrate
Openeye Name:(E)-3-[4-(diethylamino)phenyl]prop-2-enoic acid hydrate
CAS Name:(E)-3-[4-(diethylamino)phenyl]-2-propenoic acid hydrate
IUPAC Name:(E)-3-[4-(diethylamino)phenyl]prop-2-enoic acid hydrate
Traditional Name:(E)-3-[4-(diethylamino)phenyl]acrylic acid hydrate
Formula: C13H19NO3
MolecularWeight: 237.29486
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=CC(=O)O.O


Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)/C=C/C(=O)O.O


InChI

InChI=1S/C13H17NO2.H2O/c1-3-14(4-2)12-8-5-11(6-9-12)7-10-13(15)16;/h5-10H,3-4H2,1-2H3,(H,15,16);1H2/b10-7+;


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