[(E)-1-(4-piperidin-1-ylphenyl)ethylideneamino] (2S)-2-acetamido-3-phenyl-propanoate

Systemtic Name: [(E)-1-(4-piperidin-1-ylphenyl)ethylideneamino] (2S)-2-acetamido-3-phenyl-propanoate Openeye Name: [(E)-1-[4-(1-piperidyl)phenyl]ethylideneamino] (2S)-2-acetamido-3-phenyl-propanoate CAS Name: (2S)-2-acetamido-3-phenylpropanoic acid [(E)-1-[4-(1-piperidinyl)phenyl]ethylideneamino] ester IUPAC Name: [(E)-1-(4-piperidin-1-ylphenyl)ethylideneamino] (2S)-2-acetamido-3-phenylpropanoate Traditional Name: (2S)-2-acetamido-3-phenyl-propionic acid [(E)-1-(4-piperidinophenyl)ethylideneamino] ester Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)C(CC1=CC=CC=C1)NC(=O)C)C2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

C/C(=N\OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C)/C2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C24H29N3O3/c1-18(21-11-13-22(14-12-21)27-15-7-4-8-16-27)26-30-24(29)23(25-19(2)28)17-20-9-5-3-6-10-20/h3,5-6,9-14,23H,4,7-8,15-17H2,1-2H3,(H,25,28)/b26-18+/t23-/m0/s1