methyl (3S)-3-[[(S)-(4-methylphenyl)sulfinyl]amino]-7-phenylmethoxy-heptanoate

Systemtic Name: methyl (3S)-3-[[(S)-(4-methylphenyl)sulfinyl]amino]-7-phenylmethoxy-heptanoate Openeye Name: methyl (3S)-7-benzyloxy-3-[[(S)-p-tolylsulfinyl]amino]heptanoate CAS Name: (3S)-3-[[(S)-(4-methylphenyl)sulfinyl]amino]-7-phenylmethoxyheptanoic acid methyl ester IUPAC Name: methyl (3S)-3-[[(S)-(4-methylphenyl)sulfinyl]amino]-7-phenylmethoxyheptanoate Traditional Name: (3S)-7-benzoxy-3-[[(S)-p-tolylsulfinyl]amino]enanthic acid methyl ester Formula: C22H29NO4S MolecularWeight: 403.53496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)NC(CCCCOCC2=CC=CC=C2)CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=O)N[C@@H](CCCCOCC2=CC=CC=C2)CC(=O)OC

InChI

InChI=1S/C22H29NO4S/c1-18-11-13-21(14-12-18)28(25)23-20(16-22(24)26-2)10-6-7-15-27-17-19-8-4-3-5-9-19/h3-5,8-9,11-14,20,23H,6-7,10,15-17H2,1-2H3/t20-,28-/m0/s1