3-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-1,1-bis(phenylmethyl)urea

Systemtic Name: 3-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-1,1-bis(phenylmethyl)urea Openeye Name: 1,1-dibenzyl-3-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]urea CAS Name: 3-[[4-(4-morpholin-4-iumylmethyl)phenyl]methyl]-1,1-bis(phenylmethyl)urea IUPAC Name: 1,1-dibenzyl-3-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]urea Traditional Name: 1,1-dibenzyl-3-[4-(morpholin-4-ium-4-ylmethyl)benzyl]urea Formula: C27H32N3O2+ MolecularWeight: 430.56188

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)CNC(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)CNC(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O2/c31-27(28-19-23-11-13-26(14-12-23)20-29-15-17-32-18-16-29)30(21-24-7-3-1-4-8-24)22-25-9-5-2-6-10-25/h1-14H,15-22H2,(H,28,31)/p+1