3-heptyl-1-methyl-1-[3-[4-[3-(4-methylpiperidin-1-yl)-3-oxidanylidene-2-phenylmethoxy-propyl]phenyl]phenyl]urea

Systemtic Name: 3-heptyl-1-methyl-1-[3-[4-[3-(4-methylpiperidin-1-yl)-3-oxidanylidene-2-phenylmethoxy-propyl]phenyl]phenyl]urea Openeye Name: 1-[3-[4-[2-benzyloxy-3-(4-methyl-1-piperidyl)-3-oxo-propyl]phenyl]phenyl]-3-heptyl-1-methyl-urea CAS Name: 3-heptyl-1-methyl-1-[3-[4-[3-(4-methyl-1-piperidinyl)-3-oxo-2-phenylmethoxypropyl]phenyl]phenyl]urea IUPAC Name: 3-heptyl-1-methyl-1-[3-[4-[3-(4-methylpiperidin-1-yl)-3-oxo-2-phenylmethoxypropyl]phenyl]phenyl]urea Traditional Name: 1-[3-[4-[2-benzoxy-3-keto-3-(4-methylpiperidino)propyl]phenyl]phenyl]-3-heptyl-1-methyl-urea Formula: C37H49N3O3 MolecularWeight: 583.80326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)N(C)C1=CC=CC(=C1)C2=CC=C(C=C2)CC(C(=O)N3CCC(CC3)C)OCC4=CC=CC=C4

Isomeric SMILES

CCCCCCCNC(=O)N(C)C1=CC=CC(=C1)C2=CC=C(C=C2)CC(C(=O)N3CCC(CC3)C)OCC4=CC=CC=C4

InChI

InChI=1S/C37H49N3O3/c1-4-5-6-7-11-23-38-37(42)39(3)34-16-12-15-33(27-34)32-19-17-30(18-20-32)26-35(43-28-31-13-9-8-10-14-31)36(41)40-24-21-29(2)22-25-40/h8-10,12-20,27,29,35H,4-7,11,21-26,28H2,1-3H3,(H,38,42)