1-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(3-nitrophenyl)urea

Systemtic Name: 1-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(3-nitrophenyl)urea Openeye Name: 1-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(3-nitrophenyl)urea CAS Name: 1-[(2R)-2-(2-chlorophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-(3-nitrophenyl)urea IUPAC Name: 1-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3-(3-nitrophenyl)urea Traditional Name: 1-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(3-nitrophenyl)urea Formula: C19H22ClN4O3+ MolecularWeight: 389.85598

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3Cl

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3Cl

InChI

InChI=1S/C19H21ClN4O3/c20-17-9-2-1-8-16(17)18(23-10-3-4-11-23)13-21-19(25)22-14-6-5-7-15(12-14)24(26)27/h1-2,5-9,12,18H,3-4,10-11,13H2,(H2,21,22,25)/p+1/t18-/m0/s1