2-[[4-[4-(3-methoxyphenyl)piperazin-1-yl]phenyl]sulfonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[4-[4-(3-methoxyphenyl)piperazin-1-yl]phenyl]sulfonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[4-[4-(3-methoxyphenyl)piperazin-1-yl]phenyl]sulfonylamino]-3-phenyl-propanoic acid CAS Name: 2-[[4-[4-(3-methoxyphenyl)-1-piperazinyl]phenyl]sulfonylamino]-3-phenylpropanoic acid IUPAC Name: 2-[[4-[4-(3-methoxyphenyl)piperazin-1-yl]phenyl]sulfonylamino]-3-phenylpropanoic acid Traditional Name: 2-[[4-[4-(3-methoxyphenyl)piperazino]phenyl]sulfonylamino]-3-phenyl-propionic acid Formula: C26H29N3O5S MolecularWeight: 495.59056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C3=CC=C(C=C3)S(=O)(=O)NC(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=CC=C(C=C3)S(=O)(=O)NC(CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C26H29N3O5S/c1-34-23-9-5-8-22(19-23)29-16-14-28(15-17-29)21-10-12-24(13-11-21)35(32,33)27-25(26(30)31)18-20-6-3-2-4-7-20/h2-13,19,25,27H,14-18H2,1H3,(H,30,31)