[(2S)-1-[(4-chloranyl-3-methoxy-phenyl)amino]pent-4-en-2-yl]carbamic acid

Systemtic Name: [(2S)-1-[(4-chloranyl-3-methoxy-phenyl)amino]pent-4-en-2-yl]carbamic acid Openeye Name: [(1S)-1-[(4-chloro-3-methoxy-anilino)methyl]but-3-enyl]carbamic acid CAS Name: [(2S)-1-(4-chloro-3-methoxyanilino)pent-4-en-2-yl]carbamic acid IUPAC Name: [(2S)-1-(4-chloro-3-methoxyanilino)pent-4-en-2-yl]carbamic acid Traditional Name: [(1S)-1-[(4-chloro-3-methoxy-anilino)methyl]but-3-enyl]carbamic acid Formula: C13H17ClN2O3 MolecularWeight: 284.73868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NCC(CC=C)NC(=O)O)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)NC[C@H](CC=C)NC(=O)O)Cl

InChI

InChI=1S/C13H17ClN2O3/c1-3-4-10(16-13(17)18)8-15-9-5-6-11(14)12(7-9)19-2/h3,5-7,10,15-16H,1,4,8H2,2H3,(H,17,18)/t10-/m0/s1