1-[(3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-3-(3-pyrrolidin-1-ium-1-ylpropyl)urea

Systemtic Name: 1-[(3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-3-(3-pyrrolidin-1-ium-1-ylpropyl)urea Openeye Name: 1-[(3S)-5-oxo-1-(p-tolyl)pyrrolidin-3-yl]-3-(3-pyrrolidin-1-ium-1-ylpropyl)urea CAS Name: 1-[(3S)-1-(4-methylphenyl)-5-oxo-3-pyrrolidinyl]-3-[3-(1-pyrrolidin-1-iumyl)propyl]urea IUPAC Name: 1-[(3S)-1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-3-(3-pyrrolidin-1-ium-1-ylpropyl)urea Traditional Name: 1-[(3S)-5-keto-1-(p-tolyl)pyrrolidin-3-yl]-3-(3-pyrrolidin-1-ium-1-ylpropyl)urea Formula: C19H29N4O2+ MolecularWeight: 345.45916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)NC(=O)NCCC[NH+]3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)N2C[C@H](CC2=O)NC(=O)NCCC[NH+]3CCCC3

InChI

InChI=1S/C19H28N4O2/c1-15-5-7-17(8-6-15)23-14-16(13-18(23)24)21-19(25)20-9-4-12-22-10-2-3-11-22/h5-8,16H,2-4,9-14H2,1H3,(H2,20,21,25)/p+1/t16-/m0/s1