methyl (4S)-5-[3-methoxypropyl(pentyl)amino]-4-(naphthalen-2-ylsulfonylmethyl)-5-oxidanylidene-pentanoate

Systemtic Name: methyl (4S)-5-[3-methoxypropyl(pentyl)amino]-4-(naphthalen-2-ylsulfonylmethyl)-5-oxidanylidene-pentanoate Openeye Name: methyl (4S)-5-[3-methoxypropyl(pentyl)amino]-4-(2-naphthylsulfonylmethyl)-5-oxo-pentanoate CAS Name: (4S)-5-[3-methoxypropyl(pentyl)amino]-4-(2-naphthalenylsulfonylmethyl)-5-oxopentanoic acid methyl ester IUPAC Name: methyl (4S)-5-[3-methoxypropyl(pentyl)amino]-4-(naphthalen-2-ylsulfonylmethyl)-5-oxopentanoate Traditional Name: (4S)-5-[amyl(3-methoxypropyl)amino]-5-keto-4-(2-naphthylsulfonylmethyl)valeric acid methyl ester Formula: C26H37NO6S MolecularWeight: 491.64008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCOC)C(=O)C(CCC(=O)OC)CS(=O)(=O)C1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CCCCCN(CCCOC)C(=O)[C@H](CCC(=O)OC)CS(=O)(=O)C1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C26H37NO6S/c1-4-5-8-16-27(17-9-18-32-2)26(29)23(13-15-25(28)33-3)20-34(30,31)24-14-12-21-10-6-7-11-22(21)19-24/h6-7,10-12,14,19,23H,4-5,8-9,13,15-18,20H2,1-3H3/t23-/m1/s1