1-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-3-(2-pyrrolidin-1-ium-1-ylethyl)urea

Systemtic Name: 1-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-3-(2-pyrrolidin-1-ium-1-ylethyl)urea Openeye Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-(2-pyrrolidin-1-ium-1-ylethyl)urea CAS Name: 1-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]-3-[2-(1-pyrrolidin-1-iumyl)ethyl]urea IUPAC Name: 1-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-3-(2-pyrrolidin-1-ium-1-ylethyl)urea Traditional Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-(2-pyrrolidin-1-ium-1-ylethyl)urea Formula: C19H30N3O+ MolecularWeight: 316.461

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NCC[NH+]2CCCC2

Isomeric SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NCC[NH+]2CCCC2

InChI

InChI=1S/C19H29N3O/c1-15(2)16-8-7-9-17(14-16)19(3,4)21-18(23)20-10-13-22-11-5-6-12-22/h7-9,14H,1,5-6,10-13H2,2-4H3,(H2,20,21,23)/p+1