ethyl 2-ethoxy-5-[4-[(6-methylsulfonyloxynaphthalen-2-yl)methylamino]phenyl]pentanoate

Systemtic Name: ethyl 2-ethoxy-5-[4-[(6-methylsulfonyloxynaphthalen-2-yl)methylamino]phenyl]pentanoate Openeye Name: ethyl 2-ethoxy-5-[4-[(6-methylsulfonyloxy-2-naphthyl)methylamino]phenyl]pentanoate CAS Name: 2-ethoxy-5-[4-[(6-methylsulfonyloxy-2-naphthalenyl)methylamino]phenyl]pentanoic acid ethyl ester IUPAC Name: ethyl 2-ethoxy-5-[4-[(6-methylsulfonyloxynaphthalen-2-yl)methylamino]phenyl]pentanoate Traditional Name: 2-ethoxy-5-[4-[(6-methylsulfonyloxy-2-naphthyl)methylamino]phenyl]valeric acid ethyl ester Formula: C27H33NO6S MolecularWeight: 499.61902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CCCC1=CC=C(C=C1)NCC2=CC3=C(C=C2)C=C(C=C3)OS(=O)(=O)C)C(=O)OCC

Isomeric SMILES

CCOC(CCCC1=CC=C(C=C1)NCC2=CC3=C(C=C2)C=C(C=C3)OS(=O)(=O)C)C(=O)OCC

InChI

InChI=1S/C27H33NO6S/c1-4-32-26(27(29)33-5-2)8-6-7-20-10-14-24(15-11-20)28-19-21-9-12-23-18-25(34-35(3,30)31)16-13-22(23)17-21/h9-18,26,28H,4-8,19H2,1-3H3