[4-[3-(diphenylmethyl)oxy-2-oxidanyl-propyl]piperazin-1-yl]-(4-ethylphenyl)methanone

Systemtic Name: [4-[3-(diphenylmethyl)oxy-2-oxidanyl-propyl]piperazin-1-yl]-(4-ethylphenyl)methanone Openeye Name: [4-(3-benzhydryloxy-2-hydroxy-propyl)piperazin-1-yl]-(4-ethylphenyl)methanone CAS Name: [4-[3-(diphenylmethyl)oxy-2-hydroxypropyl]-1-piperazinyl]-(4-ethylphenyl)methanone IUPAC Name: [4-(3-benzhydryloxy-2-hydroxypropyl)piperazin-1-yl]-(4-ethylphenyl)methanone Traditional Name: [4-(3-benzhydryloxy-2-hydroxy-propyl)piperazino]-(4-ethylphenyl)methanone Formula: C29H34N2O3 MolecularWeight: 458.59186

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(COC(C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(COC(C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C29H34N2O3/c1-2-23-13-15-26(16-14-23)29(33)31-19-17-30(18-20-31)21-27(32)22-34-28(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,27-28,32H,2,17-22H2,1H3