N-[4-(azepan-1-ylsulfonyl)phenyl]-4-phenethyloxy-benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-phenethyloxy-benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-phenethyloxy-benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-phenethyloxybenzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-phenethyloxybenzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-phenethyloxy-benzamide Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)OCCC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)OCCC4=CC=CC=C4

InChI

InChI=1S/C27H30N2O4S/c30-27(23-10-14-25(15-11-23)33-21-18-22-8-4-3-5-9-22)28-24-12-16-26(17-13-24)34(31,32)29-19-6-1-2-7-20-29/h3-5,8-17H,1-2,6-7,18-21H2,(H,28,30)