N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3,3-diphenyl-propanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3,3-diphenyl-propanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3,3-diphenyl-propanamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-3,3-diphenylpropanamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-3,3-diphenylpropanamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3,3-diphenyl-propionamide Formula: C28H32N2O4S MolecularWeight: 492.62968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H32N2O4S/c1-34-27-17-16-24(35(32,33)30-18-10-2-3-11-19-30)20-26(27)29-28(31)21-25(22-12-6-4-7-13-22)23-14-8-5-9-15-23/h4-9,12-17,20,25H,2-3,10-11,18-19,21H2,1H3,(H,29,31)