1-(azepan-1-yl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one

Systemtic Name: 1-(azepan-1-yl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one Openeye Name: 1-(azepan-1-yl)-3-(4-morpholinosulfonylphenyl)prop-2-en-1-one CAS Name: 1-(1-azepanyl)-3-[4-(4-morpholinylsulfonyl)phenyl]-2-propen-1-one IUPAC Name: 1-(azepan-1-yl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one Traditional Name: 1-(azepan-1-yl)-3-(4-morpholinosulfonylphenyl)prop-2-en-1-one Formula: C19H26N2O4S MolecularWeight: 378.48574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C=CC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

C1CCCN(CC1)C(=O)C=CC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H26N2O4S/c22-19(20-11-3-1-2-4-12-20)10-7-17-5-8-18(9-6-17)26(23,24)21-13-15-25-16-14-21/h5-10H,1-4,11-16H2