N-[4-(azepan-1-ylsulfonyl)phenyl]-3,5-bis(chloranyl)-4-propoxy-benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3,5-bis(chloranyl)-4-propoxy-benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3,5-dichloro-4-propoxy-benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dichloro-4-propoxybenzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3,5-dichloro-4-propoxybenzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3,5-dichloro-4-propoxy-benzamide Formula: C22H26Cl2N2O4S MolecularWeight: 485.42384

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)Cl

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)Cl

InChI

InChI=1S/C22H26Cl2N2O4S/c1-2-13-30-21-19(23)14-16(15-20(21)24)22(27)25-17-7-9-18(10-8-17)31(28,29)26-11-5-3-4-6-12-26/h7-10,14-15H,2-6,11-13H2,1H3,(H,25,27)