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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC(CC2=O)NC(=O)NCCC[NH+]3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)N2C[C@H](CC2=O)NC(=O)NCCC[NH+]3CCCC3

InChI

InChI=1S/C19H28N4O3/c1-26-17-7-4-6-16(13-17)23-14-15(12-18(23)24)21-19(25)20-8-5-11-22-9-2-3-10-22/h4,6-7,13,15H,2-3,5,8-12,14H2,1H3,(H2,20,21,25)/p+1/t15-/m0/s1