2-(4-phenylpiperazin-1-yl)ethyl (E)-3-azanylbut-2-enoate

Systemtic Name: 2-(4-phenylpiperazin-1-yl)ethyl (E)-3-azanylbut-2-enoate Openeye Name: 2-(4-phenylpiperazin-1-yl)ethyl (E)-3-aminobut-2-enoate CAS Name: (E)-3-amino-2-butenoic acid 2-(4-phenyl-1-piperazinyl)ethyl ester IUPAC Name: 2-(4-phenylpiperazin-1-yl)ethyl (E)-3-aminobut-2-enoate Traditional Name: (E)-3-aminobut-2-enoic acid 2-(4-phenylpiperazino)ethyl ester Formula: C16H23N3O2 MolecularWeight: 289.37272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OCCN1CCN(CC1)C2=CC=CC=C2)N

Isomeric SMILES

C/C(=C\C(=O)OCCN1CCN(CC1)C2=CC=CC=C2)/N

InChI

InChI=1S/C16H23N3O2/c1-14(17)13-16(20)21-12-11-18-7-9-19(10-8-18)15-5-3-2-4-6-15/h2-6,13H,7-12,17H2,1H3/b14-13+