N-[3-[[[(2S)-2-(4-cyanophenoxy)propanoyl]amino]methyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[[[(2S)-2-(4-cyanophenoxy)propanoyl]amino]methyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[[(2S)-2-(4-cyanophenoxy)propanoyl]amino]methyl]phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[[(2S)-2-(4-cyanophenoxy)-1-oxopropyl]amino]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[[(2S)-2-(4-cyanophenoxy)propanoyl]amino]methyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[[(2S)-2-(4-cyanophenoxy)propanoyl]amino]methyl]phenyl]cyclopropanecarboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=CC=C1)NC(=O)C2CC2)OC3=CC=C(C=C3)C#N

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC(=CC=C1)NC(=O)C2CC2)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H21N3O3/c1-14(27-19-9-5-15(12-22)6-10-19)20(25)23-13-16-3-2-4-18(11-16)24-21(26)17-7-8-17/h2-6,9-11,14,17H,7-8,13H2,1H3,(H,23,25)(H,24,26)/t14-/m0/s1