1-[(3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-3-(2-morpholin-4-ium-4-ylethyl)urea

Systemtic Name: 1-[(3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-3-(2-morpholin-4-ium-4-ylethyl)urea Openeye Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[(3S)-5-oxo-1-(p-tolyl)pyrrolidin-3-yl]urea CAS Name: 1-[(3S)-1-(4-methylphenyl)-5-oxo-3-pyrrolidinyl]-3-[2-(4-morpholin-4-iumyl)ethyl]urea IUPAC Name: 1-[(3S)-1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-3-(2-morpholin-4-ium-4-ylethyl)urea Traditional Name: 1-[(3S)-5-keto-1-(p-tolyl)pyrrolidin-3-yl]-3-(2-morpholin-4-ium-4-ylethyl)urea Formula: C18H27N4O3+ MolecularWeight: 347.43198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)NC(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)N2C[C@H](CC2=O)NC(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C18H26N4O3/c1-14-2-4-16(5-3-14)22-13-15(12-17(22)23)20-18(24)19-6-7-21-8-10-25-11-9-21/h2-5,15H,6-13H2,1H3,(H2,19,20,24)/p+1/t15-/m0/s1