1-[(1S)-2,2-dimethyl-1-phenyl-propyl]-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]urea

Systemtic Name: 1-[(1S)-2,2-dimethyl-1-phenyl-propyl]-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]urea Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-[(1S)-2,2-dimethyl-1-phenyl-propyl]urea CAS Name: 1-[(1S)-2,2-dimethyl-1-phenylpropyl]-3-[1-(phenylmethyl)-4-piperidin-1-iumyl]urea IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-[(1S)-2,2-dimethyl-1-phenylpropyl]urea Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-[(1S)-2,2-dimethyl-1-phenyl-propyl]urea Formula: C24H34N3O+ MolecularWeight: 380.54626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C1=CC=CC=C1)NC(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)[C@@H](C1=CC=CC=C1)NC(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C24H33N3O/c1-24(2,3)22(20-12-8-5-9-13-20)26-23(28)25-21-14-16-27(17-15-21)18-19-10-6-4-7-11-19/h4-13,21-22H,14-18H2,1-3H3,(H2,25,26,28)/p+1/t22-/m1/s1