1-(3,5-dimethoxyphenyl)-3-[4-(4-octanoylpiperazin-1-yl)phenyl]urea

Systemtic Name: 1-(3,5-dimethoxyphenyl)-3-[4-(4-octanoylpiperazin-1-yl)phenyl]urea Openeye Name: 1-(3,5-dimethoxyphenyl)-3-[4-(4-octanoylpiperazin-1-yl)phenyl]urea CAS Name: 1-(3,5-dimethoxyphenyl)-3-[4-[4-(1-oxooctyl)-1-piperazinyl]phenyl]urea IUPAC Name: 1-(3,5-dimethoxyphenyl)-3-[4-(4-octanoylpiperazin-1-yl)phenyl]urea Traditional Name: 1-[4-(4-caprylylpiperazino)phenyl]-3-(3,5-dimethoxyphenyl)urea Formula: C27H38N4O4 MolecularWeight: 482.61502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C27H38N4O4/c1-4-5-6-7-8-9-26(32)31-16-14-30(15-17-31)23-12-10-21(11-13-23)28-27(33)29-22-18-24(34-2)20-25(19-22)35-3/h10-13,18-20H,4-9,14-17H2,1-3H3,(H2,28,29,33)