1-(3-methylbutyl)-3-phenyl-1-(1-propan-2-ylpiperidin-1-ium-4-yl)urea

Systemtic Name: 1-(3-methylbutyl)-3-phenyl-1-(1-propan-2-ylpiperidin-1-ium-4-yl)urea Openeye Name: 1-isopentyl-1-(1-isopropylpiperidin-1-ium-4-yl)-3-phenyl-urea CAS Name: 1-(3-methylbutyl)-3-phenyl-1-(1-propan-2-yl-4-piperidin-1-iumyl)urea IUPAC Name: 1-(3-methylbutyl)-3-phenyl-1-(1-propan-2-ylpiperidin-1-ium-4-yl)urea Traditional Name: 1-isoamyl-1-(1-isopropylpiperidin-1-ium-4-yl)-3-phenyl-urea Formula: C20H34N3O+ MolecularWeight: 332.50346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C1CC[NH+](CC1)C(C)C)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)CCN(C1CC[NH+](CC1)C(C)C)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C20H33N3O/c1-16(2)10-15-23(19-11-13-22(14-12-19)17(3)4)20(24)21-18-8-6-5-7-9-18/h5-9,16-17,19H,10-15H2,1-4H3,(H,21,24)/p+1