3-[(3S)-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)urea

Systemtic Name: 3-[(3S)-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)urea Openeye Name: 3-[(3S)-1-(3-methoxyphenyl)-5-oxo-pyrrolidin-3-yl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)urea CAS Name: 3-[(3S)-1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinyl]-1-methyl-1-(1-methyl-4-piperidin-1-iumyl)urea IUPAC Name: 3-[(3S)-1-(3-methoxyphenyl)-5-oxopyrrolidin-3-yl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)urea Traditional Name: 3-[(3S)-5-keto-1-(3-methoxyphenyl)pyrrolidin-3-yl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)urea Formula: C19H29N4O3+ MolecularWeight: 361.45856

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C(=O)NC2CC(=O)N(C2)C3=CC(=CC=C3)OC

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C(=O)N[C@H]2CC(=O)N(C2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C19H28N4O3/c1-21-9-7-15(8-10-21)22(2)19(25)20-14-11-18(24)23(13-14)16-5-4-6-17(12-16)26-3/h4-6,12,14-15H,7-11,13H2,1-3H3,(H,20,25)/p+1/t14-/m0/s1