1-methyl-1-[1-oxidanyl-1-[(3-prop-2-enoxyphenyl)methyl]-3,4-dihydro-2H-quinolin-1-ium-6-yl]urea

Systemtic Name: 1-methyl-1-[1-oxidanyl-1-[(3-prop-2-enoxyphenyl)methyl]-3,4-dihydro-2H-quinolin-1-ium-6-yl]urea Openeye Name: 1-[1-[(3-allyloxyphenyl)methyl]-1-hydroxy-3,4-dihydro-2H-quinolin-1-ium-6-yl]-1-methyl-urea CAS Name: 1-[1-hydroxy-1-[(3-prop-2-enoxyphenyl)methyl]-3,4-dihydro-2H-quinolin-1-ium-6-yl]-1-methylurea IUPAC Name: 1-[1-hydroxy-1-[(3-prop-2-enoxyphenyl)methyl]-3,4-dihydro-2H-quinolin-1-ium-6-yl]-1-methylurea Traditional Name: 1-[1-(3-allyloxybenzyl)-1-hydroxy-3,4-dihydro-2H-quinolin-1-ium-6-yl]-1-methyl-urea Formula: C21H26N3O3+ MolecularWeight: 368.44944

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC2=C(C=C1)[N+](CCC2)(CC3=CC(=CC=C3)OCC=C)O)C(=O)N

Isomeric SMILES

CN(C1=CC2=C(C=C1)[N+](CCC2)(CC3=CC(=CC=C3)OCC=C)O)C(=O)N

InChI

InChI=1S/C21H25N3O3/c1-3-12-27-19-8-4-6-16(13-19)15-24(26)11-5-7-17-14-18(9-10-20(17)24)23(2)21(22)25/h3-4,6,8-10,13-14,26H,1,5,7,11-12,15H2,2H3,(H-,22,25)/p+1