tert-butyl (E)-3-(5-methylsulfonyl-6H-phenanthridin-2-yl)prop-2-enoate

Systemtic Name: tert-butyl (E)-3-(5-methylsulfonyl-6H-phenanthridin-2-yl)prop-2-enoate Openeye Name: tert-butyl (E)-3-(5-methylsulfonyl-6H-phenanthridin-2-yl)prop-2-enoate CAS Name: (E)-3-(5-methylsulfonyl-6H-phenanthridin-2-yl)-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-(5-methylsulfonyl-6H-phenanthridin-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-mesyl-6H-phenanthridin-2-yl)acrylic acid tert-butyl ester Formula: C21H23NO4S MolecularWeight: 385.47662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CC1=CC2=C(C=C1)N(CC3=CC=CC=C32)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/C1=CC2=C(C=C1)N(CC3=CC=CC=C32)S(=O)(=O)C

InChI

InChI=1S/C21H23NO4S/c1-21(2,3)26-20(23)12-10-15-9-11-19-18(13-15)17-8-6-5-7-16(17)14-22(19)27(4,24)25/h5-13H,14H2,1-4H3/b12-10+