1-[2-(1-sulfanylnaphthalen-2-yl)prop-2-enoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(1-sulfanylnaphthalen-2-yl)prop-2-enoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(1-sulfanyl-2-naphthyl)prop-2-enoyl]piperidine-4-carboxylic acid CAS Name: 1-[2-(1-mercapto-2-naphthalenyl)-1-oxoprop-2-enyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(1-sulfanylnaphthalen-2-yl)prop-2-enoyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(1-mercapto-2-naphthyl)acryloyl]isonipecotic acid Formula: C19H19NO3S MolecularWeight: 341.42406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=C(C2=CC=CC=C2C=C1)S)C(=O)N3CCC(CC3)C(=O)O

Isomeric SMILES

C=C(C1=C(C2=CC=CC=C2C=C1)S)C(=O)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C19H19NO3S/c1-12(18(21)20-10-8-14(9-11-20)19(22)23)15-7-6-13-4-2-3-5-16(13)17(15)24/h2-7,14,24H,1,8-11H2,(H,22,23)