3-(3-chlorophenyl)-1,1-bis(4-phenylbutyl)urea

Systemtic Name: 3-(3-chlorophenyl)-1,1-bis(4-phenylbutyl)urea Openeye Name: 3-(3-chlorophenyl)-1,1-bis(4-phenylbutyl)urea CAS Name: 3-(3-chlorophenyl)-1,1-bis(4-phenylbutyl)urea IUPAC Name: 3-(3-chlorophenyl)-1,1-bis(4-phenylbutyl)urea Traditional Name: 3-(3-chlorophenyl)-1,1-bis(4-phenylbutyl)urea Formula: C27H31ClN2O MolecularWeight: 435.00084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCN(CCCCC2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCCN(CCCCC2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C27H31ClN2O/c28-25-18-11-19-26(22-25)29-27(31)30(20-9-7-16-23-12-3-1-4-13-23)21-10-8-17-24-14-5-2-6-15-24/h1-6,11-15,18-19,22H,7-10,16-17,20-21H2,(H,29,31)