1-[4-[4-[4-(1,2-benzoxazol-3-yl)piperidin-1-yl]-3-phenyl-butoxy]-3-methoxy-phenyl]ethanone

Systemtic Name: 1-[4-[4-[4-(1,2-benzoxazol-3-yl)piperidin-1-yl]-3-phenyl-butoxy]-3-methoxy-phenyl]ethanone Openeye Name: 1-[4-[4-[4-(1,2-benzoxazol-3-yl)-1-piperidyl]-3-phenyl-butoxy]-3-methoxy-phenyl]ethanone CAS Name: 1-[4-[4-[4-(1,2-benzoxazol-3-yl)-1-piperidinyl]-3-phenylbutoxy]-3-methoxyphenyl]ethanone IUPAC Name: 1-[4-[4-[4-(1,2-benzoxazol-3-yl)piperidin-1-yl]-3-phenylbutoxy]-3-methoxyphenyl]ethanone Traditional Name: 1-[4-[4-(4-indoxazen-3-ylpiperidino)-3-phenyl-butoxy]-3-methoxy-phenyl]ethanone Formula: C31H34N2O4 MolecularWeight: 498.61266

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCCC(CN2CCC(CC2)C3=NOC4=CC=CC=C43)C5=CC=CC=C5)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCCC(CN2CCC(CC2)C3=NOC4=CC=CC=C43)C5=CC=CC=C5)OC

InChI

InChI=1S/C31H34N2O4/c1-22(34)25-12-13-29(30(20-25)35-2)36-19-16-26(23-8-4-3-5-9-23)21-33-17-14-24(15-18-33)31-27-10-6-7-11-28(27)37-32-31/h3-13,20,24,26H,14-19,21H2,1-2H3