(E)-1-phenylpent-3-en-2-amine dihydrate

Systemtic Name: (E)-1-phenylpent-3-en-2-amine dihydrate Openeye Name: (E)-1-phenylpent-3-en-2-amine dihydrate CAS Name: (E)-1-phenyl-3-penten-2-amine dihydrate IUPAC Name: (E)-1-phenylpent-3-en-2-amine dihydrate Traditional Name: [(E)-1-benzylbut-2-enyl]amine dihydrate Formula: C11H19NO2 MolecularWeight: 197.27406

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(CC1=CC=CC=C1)N.O.O

Isomeric SMILES

C/C=C/C(CC1=CC=CC=C1)N.O.O

InChI

InChI=1S/C11H15N.2H2O/c1-2-6-11(12)9-10-7-4-3-5-8-10;;/h2-8,11H,9,12H2,1H3;2*1H2/b6-2+;;