(E)-3-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]acrylic acid Formula: C17H23NO2 MolecularWeight: 273.37002

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CC1C)NC2=CC=CC(=C2)C=CC(=O)O

Isomeric SMILES

CCCC(C1CC1C)NC2=CC=CC(=C2)/C=C/C(=O)O

InChI

InChI=1S/C17H23NO2/c1-3-5-16(15-10-12(15)2)18-14-7-4-6-13(11-14)8-9-17(19)20/h4,6-9,11-12,15-16,18H,3,5,10H2,1-2H3,(H,19,20)/b9-8+