(phenylmethyl) 2-[(4-methylphenyl)sulfonyl-propyl-amino]-6-azaspiro[2.4]heptane-6-carboxylate

Systemtic Name: (phenylmethyl) 2-[(4-methylphenyl)sulfonyl-propyl-amino]-6-azaspiro[2.4]heptane-6-carboxylate Openeye Name: benzyl 2-[propyl(p-tolylsulfonyl)amino]-6-azaspiro[2.4]heptane-6-carboxylate CAS Name: 2-[(4-methylphenyl)sulfonyl-propylamino]-6-azaspiro[2.4]heptane-6-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(4-methylphenyl)sulfonyl-propylamino]-6-azaspiro[2.4]heptane-6-carboxylate Traditional Name: 2-[propyl(tosyl)amino]-6-azaspiro[2.4]heptane-6-carboxylic acid benzyl ester Formula: C24H30N2O4S MolecularWeight: 442.571

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CC12CCN(C2)C(=O)OCC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCN(C1CC12CCN(C2)C(=O)OCC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C24H30N2O4S/c1-3-14-26(31(28,29)21-11-9-19(2)10-12-21)22-16-24(22)13-15-25(18-24)23(27)30-17-20-7-5-4-6-8-20/h4-12,22H,3,13-18H2,1-2H3