but-3-enoic acid; 3-ethenylazepan-2-one

Systemtic Name: but-3-enoic acid; 3-ethenylazepan-2-one Openeye Name: but-3-enoic acid; 3-vinylazepan-2-one CAS Name: 3-butenoic acid; 3-ethenyl-2-azepanone IUPAC Name: but-3-enoic acid; 3-ethenylazepan-2-one Traditional Name: but-3-enoic acid; 3-vinylazepan-2-one Formula: C12H19NO3 MolecularWeight: 225.28416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC(=O)O.C=CC1CCCCNC1=O

Isomeric SMILES

C=CCC(=O)O.C=CC1CCCCNC1=O

InChI

InChI=1S/C8H13NO.C4H6O2/c1-2-7-5-3-4-6-9-8(7)10;1-2-3-4(5)6/h2,7H,1,3-6H2,(H,9,10);2H,1,3H2,(H,5,6)