4-[(E)-3-[4-(azepan-1-ylsulfonyl)phenyl]prop-2-enoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[(E)-3-[4-(azepan-1-ylsulfonyl)phenyl]prop-2-enoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[(E)-3-[4-(azepan-1-ylsulfonyl)phenyl]prop-2-enoyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[(E)-3-[4-(1-azepanylsulfonyl)phenyl]-1-oxoprop-2-enyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[(E)-3-[4-(azepan-1-ylsulfonyl)phenyl]prop-2-enoyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[(E)-3-[4-(azepan-1-ylsulfonyl)phenyl]acryloyl]-1,3-dihydroquinoxalin-2-one Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C=CC(=O)N3CC(=O)NC4=CC=CC=C43

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)N3CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C23H25N3O4S/c27-22-17-26(21-8-4-3-7-20(21)24-22)23(28)14-11-18-9-12-19(13-10-18)31(29,30)25-15-5-1-2-6-16-25/h3-4,7-14H,1-2,5-6,15-17H2,(H,24,27)/b14-11+