methyl 4-(dipentylamino)-3-(naphthalen-2-ylsulfonylmethyl)-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-(dipentylamino)-3-(naphthalen-2-ylsulfonylmethyl)-4-oxidanylidene-butanoate Openeye Name: methyl 4-(dipentylamino)-3-(2-naphthylsulfonylmethyl)-4-oxo-butanoate CAS Name: 4-(dipentylamino)-3-(2-naphthalenylsulfonylmethyl)-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(dipentylamino)-3-(naphthalen-2-ylsulfonylmethyl)-4-oxobutanoate Traditional Name: 4-(diamylamino)-4-keto-3-(2-naphthylsulfonylmethyl)butyric acid methyl ester Formula: C26H37NO5S MolecularWeight: 475.64068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H37NO5S/c1-4-6-10-16-27(17-11-7-5-2)26(29)23(19-25(28)32-3)20-33(30,31)24-15-14-21-12-8-9-13-22(21)18-24/h8-9,12-15,18,23H,4-7,10-11,16-17,19-20H2,1-3H3