ethyl (E)-7-(benzotriazol-2-yl)-6-methyl-7-morpholin-4-yl-hept-2-enoate

Systemtic Name: ethyl (E)-7-(benzotriazol-2-yl)-6-methyl-7-morpholin-4-yl-hept-2-enoate Openeye Name: ethyl (E)-7-(benzotriazol-2-yl)-6-methyl-7-morpholino-hept-2-enoate CAS Name: (E)-7-(2-benzotriazolyl)-6-methyl-7-(4-morpholinyl)-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-(benzotriazol-2-yl)-6-methyl-7-morpholin-4-ylhept-2-enoate Traditional Name: (E)-7-(benzotriazol-2-yl)-6-methyl-7-morpholino-hept-2-enoic acid ethyl ester Formula: C20H28N4O3 MolecularWeight: 372.46132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCCC(C)C(N1CCOCC1)N2N=C3C=CC=CC3=N2

Isomeric SMILES

CCOC(=O)/C=C/CCC(C)C(N1CCOCC1)N2N=C3C=CC=CC3=N2

InChI

InChI=1S/C20H28N4O3/c1-3-27-19(25)11-7-4-8-16(2)20(23-12-14-26-15-13-23)24-21-17-9-5-6-10-18(17)22-24/h5-7,9-11,16,20H,3-4,8,12-15H2,1-2H3/b11-7+