N-[1-[4-bromanyl-2-ethoxy-3-(phenylsulfonyl)phenyl]-3-oxidanylidene-propyl]methanamide

Systemtic Name: N-[1-[4-bromanyl-2-ethoxy-3-(phenylsulfonyl)phenyl]-3-oxidanylidene-propyl]methanamide Openeye Name: N-[1-[3-(benzenesulfonyl)-4-bromo-2-ethoxy-phenyl]-3-oxo-propyl]formamide CAS Name: N-[1-[3-(benzenesulfonyl)-4-bromo-2-ethoxyphenyl]-3-oxopropyl]formamide IUPAC Name: N-[1-[3-(benzenesulfonyl)-4-bromo-2-ethoxyphenyl]-3-oxopropyl]formamide Traditional Name: N-[1-(3-besyl-4-bromo-2-ethoxy-phenyl)-3-keto-propyl]formamide Formula: C18H18BrNO5S MolecularWeight: 440.30822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1S(=O)(=O)C2=CC=CC=C2)Br)C(CC=O)NC=O

Isomeric SMILES

CCOC1=C(C=CC(=C1S(=O)(=O)C2=CC=CC=C2)Br)C(CC=O)NC=O

InChI

InChI=1S/C18H18BrNO5S/c1-2-25-17-14(16(10-11-21)20-12-22)8-9-15(19)18(17)26(23,24)13-6-4-3-5-7-13/h3-9,11-12,16H,2,10H2,1H3,(H,20,22)