(2S)-2-[[4-(4-fluorophenyl)piperazin-1-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[[4-(4-fluorophenyl)piperazin-1-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: (2S)-2-[[4-(4-fluorophenyl)piperazine-1-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[[4-(4-fluorophenyl)piperazine-1-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[4-(4-fluorophenyl)piperazine-1-carbonyl]amino]-3-phenyl-propionate Formula: C20H21FN3O3- MolecularWeight: 370.397443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)NC(CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C20H22FN3O3/c21-16-6-8-17(9-7-16)23-10-12-24(13-11-23)20(27)22-18(19(25)26)14-15-4-2-1-3-5-15/h1-9,18H,10-14H2,(H,22,27)(H,25,26)/p-1/t18-/m0/s1