6-(4-phenylpiperidin-1-yl)hexyl (E)-3-azanylbut-2-enoate

Systemtic Name: 6-(4-phenylpiperidin-1-yl)hexyl (E)-3-azanylbut-2-enoate Openeye Name: 6-(4-phenyl-1-piperidyl)hexyl (E)-3-aminobut-2-enoate CAS Name: (E)-3-amino-2-butenoic acid 6-(4-phenyl-1-piperidinyl)hexyl ester IUPAC Name: 6-(4-phenylpiperidin-1-yl)hexyl (E)-3-aminobut-2-enoate Traditional Name: (E)-3-aminobut-2-enoic acid 6-(4-phenylpiperidino)hexyl ester Formula: C21H32N2O2 MolecularWeight: 344.49098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OCCCCCCN1CCC(CC1)C2=CC=CC=C2)N

Isomeric SMILES

C/C(=C\C(=O)OCCCCCCN1CCC(CC1)C2=CC=CC=C2)/N

InChI

InChI=1S/C21H32N2O2/c1-18(22)17-21(24)25-16-8-3-2-7-13-23-14-11-20(12-15-23)19-9-5-4-6-10-19/h4-6,9-10,17,20H,2-3,7-8,11-16,22H2,1H3/b18-17+