2-(3-methylphenoxy)ethyl 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: 2-(3-methylphenoxy)ethyl 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate Openeye Name: 2-(3-methylphenoxy)ethyl 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-phenyl-1-piperazinyl)sulfonyl]benzoic acid 2-(3-methylphenoxy)ethyl ester IUPAC Name: 2-(3-methylphenoxy)ethyl 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-phenylpiperazino)sulfonylbenzoic acid 2-(3-methylphenoxy)ethyl ester Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCOC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)OCCOC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H28N2O5S/c1-21-7-5-11-24(19-21)32-17-18-33-26(29)22-8-6-12-25(20-22)34(30,31)28-15-13-27(14-16-28)23-9-3-2-4-10-23/h2-12,19-20H,13-18H2,1H3