1-(3-morpholin-4-ium-4-ylpropyl)-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea

Systemtic Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Openeye Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-(3-morpholin-4-ium-4-ylpropyl)urea CAS Name: 1-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]-3-[3-(4-morpholin-4-iumyl)propyl]urea IUPAC Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Traditional Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-(3-morpholin-4-ium-4-ylpropyl)urea Formula: C20H32N3O2+ MolecularWeight: 346.48698

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NCCC[NH+]2CCOCC2

Isomeric SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C20H31N3O2/c1-16(2)17-7-5-8-18(15-17)20(3,4)22-19(24)21-9-6-10-23-11-13-25-14-12-23/h5,7-8,15H,1,6,9-14H2,2-4H3,(H2,21,22,24)/p+1