N-[(1S)-1-(3,4-dipropoxyphenyl)ethyl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[(1S)-1-(3,4-dipropoxyphenyl)ethyl]-4-methylsulfonyl-benzamide Openeye Name: N-[(1S)-1-(3,4-dipropoxyphenyl)ethyl]-4-methylsulfonyl-benzamide CAS Name: N-[(1S)-1-(3,4-dipropoxyphenyl)ethyl]-4-methylsulfonylbenzamide IUPAC Name: N-[(1S)-1-(3,4-dipropoxyphenyl)ethyl]-4-methylsulfonylbenzamide Traditional Name: N-[(1S)-1-(3,4-dipropoxyphenyl)ethyl]-4-mesyl-benzamide Formula: C22H29NO5S MolecularWeight: 419.53436

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(C)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@H](C)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C)OCCC

InChI

InChI=1S/C22H29NO5S/c1-5-13-27-20-12-9-18(15-21(20)28-14-6-2)16(3)23-22(24)17-7-10-19(11-8-17)29(4,25)26/h7-12,15-16H,5-6,13-14H2,1-4H3,(H,23,24)/t16-/m0/s1