1-[4-[4,4-bis(4-methoxyphenyl)butyl]piperazin-1-yl]-3-phenoxy-propan-2-ol

Systemtic Name: 1-[4-[4,4-bis(4-methoxyphenyl)butyl]piperazin-1-yl]-3-phenoxy-propan-2-ol Openeye Name: 1-[4-[4,4-bis(4-methoxyphenyl)butyl]piperazin-1-yl]-3-phenoxy-propan-2-ol CAS Name: 1-[4-[4,4-bis(4-methoxyphenyl)butyl]-1-piperazinyl]-3-phenoxy-2-propanol IUPAC Name: 1-[4-[4,4-bis(4-methoxyphenyl)butyl]piperazin-1-yl]-3-phenoxypropan-2-ol Traditional Name: 1-[4-[4,4-bis(4-methoxyphenyl)butyl]piperazino]-3-phenoxy-propan-2-ol Formula: C31H40N2O4 MolecularWeight: 504.6603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CCCN2CCN(CC2)CC(COC3=CC=CC=C3)O)C4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(CCCN2CCN(CC2)CC(COC3=CC=CC=C3)O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C31H40N2O4/c1-35-28-14-10-25(11-15-28)31(26-12-16-29(36-2)17-13-26)9-6-18-32-19-21-33(22-20-32)23-27(34)24-37-30-7-4-3-5-8-30/h3-5,7-8,10-17,27,31,34H,6,9,18-24H2,1-2H3