3-(azepan-1-ylsulfonyl)-4-ethoxy-N-phenethyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-ethoxy-N-phenethyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-ethoxy-N-phenethyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-ethoxy-N-phenethylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-ethoxy-N-phenethylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-ethoxy-N-phenethyl-benzamide Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCCC2=CC=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCCC2=CC=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H30N2O4S/c1-2-29-21-13-12-20(23(26)24-15-14-19-10-6-5-7-11-19)18-22(21)30(27,28)25-16-8-3-4-9-17-25/h5-7,10-13,18H,2-4,8-9,14-17H2,1H3,(H,24,26)