3-(azepan-1-ylsulfonyl)-4-methoxy-N-methyl-N-[(4-prop-2-enoxyphenyl)methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-methyl-N-[(4-prop-2-enoxyphenyl)methyl]benzamide Openeye Name: N-[(4-allyloxyphenyl)methyl]-3-(azepan-1-ylsulfonyl)-4-methoxy-N-methyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-methyl-N-[(4-prop-2-enoxyphenyl)methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-methyl-N-[(4-prop-2-enoxyphenyl)methyl]benzamide Traditional Name: N-(4-allyloxybenzyl)-3-(azepan-1-ylsulfonyl)-4-methoxy-N-methyl-benzamide Formula: C25H32N2O5S MolecularWeight: 472.59698

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OCC=C)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(CC1=CC=C(C=C1)OCC=C)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C25H32N2O5S/c1-4-17-32-22-12-9-20(10-13-22)19-26(2)25(28)21-11-14-23(31-3)24(18-21)33(29,30)27-15-7-5-6-8-16-27/h4,9-14,18H,1,5-8,15-17,19H2,2-3H3