1-pentan-3-yl-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]urea

Systemtic Name: 1-pentan-3-yl-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]urea Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(1-ethylpropyl)urea CAS Name: 1-pentan-3-yl-3-[1-(phenylmethyl)-4-piperidin-1-iumyl]urea IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-pentan-3-ylurea Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(1-ethylpropyl)urea Formula: C18H30N3O+ MolecularWeight: 304.4503

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)NC1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

CCC(CC)NC(=O)NC1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C18H29N3O/c1-3-16(4-2)19-18(22)20-17-10-12-21(13-11-17)14-15-8-6-5-7-9-15/h5-9,16-17H,3-4,10-14H2,1-2H3,(H2,19,20,22)/p+1