prop-2-enyl (2R,5S)-2-[(E)-3-azanyl-3-oxidanylidene-prop-1-enyl]-5-sulfanyl-piperidine-1-carboxylate

Systemtic Name: prop-2-enyl (2R,5S)-2-[(E)-3-azanyl-3-oxidanylidene-prop-1-enyl]-5-sulfanyl-piperidine-1-carboxylate Openeye Name: allyl (2R,5S)-2-[(E)-3-amino-3-oxo-prop-1-enyl]-5-sulfanyl-piperidine-1-carboxylate CAS Name: (2R,5S)-2-[(E)-3-amino-3-oxoprop-1-enyl]-5-mercapto-1-piperidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2R,5S)-2-[(E)-3-amino-3-oxoprop-1-enyl]-5-sulfanylpiperidine-1-carboxylate Traditional Name: (2R,5S)-2-[(E)-3-amino-3-keto-prop-1-enyl]-5-mercapto-piperidine-1-carboxylic acid allyl ester Formula: C12H18N2O3S MolecularWeight: 270.34792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CC(CCC1C=CC(=O)N)S

Isomeric SMILES

C=CCOC(=O)N1C[C@H](CC[C@@H]1/C=C/C(=O)N)S

InChI

InChI=1S/C12H18N2O3S/c1-2-7-17-12(16)14-8-10(18)5-3-9(14)4-6-11(13)15/h2,4,6,9-10,18H,1,3,5,7-8H2,(H2,13,15)/b6-4+/t9-,10+/m1/s1