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

Systemtic Name: 3-heptyl-1-methyl-1-[3-[4-(3-oxidanylidene-3-piperidin-1-yl-2-propoxy-propyl)phenyl]phenyl]urea Openeye Name: 3-heptyl-1-methyl-1-[3-[4-[3-oxo-3-(1-piperidyl)-2-propoxy-propyl]phenyl]phenyl]urea CAS Name: 3-heptyl-1-methyl-1-[3-[4-[3-oxo-3-(1-piperidinyl)-2-propoxypropyl]phenyl]phenyl]urea IUPAC Name: 3-heptyl-1-methyl-1-[3-[4-(3-oxo-3-piperidin-1-yl-2-propoxypropyl)phenyl]phenyl]urea Traditional Name: 3-heptyl-1-[3-[4-(3-keto-3-piperidino-2-propoxy-propyl)phenyl]phenyl]-1-methyl-urea Formula: C32H47N3O3 MolecularWeight: 521.73388

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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)N3CCCCC3)OCCC

Isomeric SMILES

CCCCCCCNC(=O)N(C)C1=CC=CC(=C1)C2=CC=C(C=C2)CC(C(=O)N3CCCCC3)OCCC

InChI

InChI=1S/C32H47N3O3/c1-4-6-7-8-10-20-33-32(37)34(3)29-15-13-14-28(25-29)27-18-16-26(17-19-27)24-30(38-23-5-2)31(36)35-21-11-9-12-22-35/h13-19,25,30H,4-12,20-24H2,1-3H3,(H,33,37)