1-(3,4-dichlorophenyl)-3-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]urea

Systemtic Name: 1-(3,4-dichlorophenyl)-3-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]urea Openeye Name: 1-(3,4-dichlorophenyl)-3-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]urea CAS Name: 1-(3,4-dichlorophenyl)-3-[[6-(1-pyrrolidinyl)-3-pyridin-1-iumyl]methyl]urea IUPAC Name: 1-(3,4-dichlorophenyl)-3-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]urea Traditional Name: 1-(3,4-dichlorophenyl)-3-[(6-pyrrolidinopyridin-1-ium-3-yl)methyl]urea Formula: C17H19Cl2N4O+ MolecularWeight: 366.26496

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C=C(C=C2)CNC(=O)NC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCN(C1)C2=[NH+]C=C(C=C2)CNC(=O)NC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H18Cl2N4O/c18-14-5-4-13(9-15(14)19)22-17(24)21-11-12-3-6-16(20-10-12)23-7-1-2-8-23/h3-6,9-10H,1-2,7-8,11H2,(H2,21,22,24)/p+1