ethyl 7-[methylsulfonyl-[(4-phenylphenyl)methyl]amino]heptanoate

Systemtic Name: ethyl 7-[methylsulfonyl-[(4-phenylphenyl)methyl]amino]heptanoate Openeye Name: ethyl 7-[methylsulfonyl-[(4-phenylphenyl)methyl]amino]heptanoate CAS Name: 7-[methylsulfonyl-[(4-phenylphenyl)methyl]amino]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[methylsulfonyl-[(4-phenylphenyl)methyl]amino]heptanoate Traditional Name: 7-[mesyl-(4-phenylbenzyl)amino]enanthic acid ethyl ester Formula: C23H31NO4S MolecularWeight: 417.56154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCN(CC1=CC=C(C=C1)C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)CCCCCCN(CC1=CC=C(C=C1)C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C23H31NO4S/c1-3-28-23(25)13-9-4-5-10-18-24(29(2,26)27)19-20-14-16-22(17-15-20)21-11-7-6-8-12-21/h6-8,11-12,14-17H,3-5,9-10,13,18-19H2,1-2H3