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

Systemtic Name: 1-[(3S)-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-3-(2-morpholin-4-ium-4-ylethyl)urea Openeye Name: 1-[(3S)-1-(3-methoxyphenyl)-5-oxo-pyrrolidin-3-yl]-3-(2-morpholin-4-ium-4-ylethyl)urea CAS Name: 1-[(3S)-1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinyl]-3-[2-(4-morpholin-4-iumyl)ethyl]urea IUPAC Name: 1-[(3S)-1-(3-methoxyphenyl)-5-oxopyrrolidin-3-yl]-3-(2-morpholin-4-ium-4-ylethyl)urea Traditional Name: 1-[(3S)-5-keto-1-(3-methoxyphenyl)pyrrolidin-3-yl]-3-(2-morpholin-4-ium-4-ylethyl)urea Formula: C18H27N4O4+ MolecularWeight: 363.43138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC(CC2=O)NC(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

COC1=CC=CC(=C1)N2C[C@H](CC2=O)NC(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C18H26N4O4/c1-25-16-4-2-3-15(12-16)22-13-14(11-17(22)23)20-18(24)19-5-6-21-7-9-26-10-8-21/h2-4,12,14H,5-11,13H2,1H3,(H2,19,20,24)/p+1/t14-/m0/s1