1-[(phenylmethyl)carbamoylamino]-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]cyclopentane-1-carboxamide

Systemtic Name: 1-[(phenylmethyl)carbamoylamino]-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]cyclopentane-1-carboxamide Openeye Name: 1-(benzylcarbamoylamino)-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]cyclopentanecarboxamide CAS Name: 1-[[oxo-[(phenylmethyl)amino]methyl]amino]-N-[[6-(1-pyrrolidinyl)-3-pyridin-1-iumyl]methyl]-1-cyclopentanecarboxamide IUPAC Name: 1-(benzylcarbamoylamino)-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]cyclopentane-1-carboxamide Traditional Name: 1-(benzylcarbamoylamino)-N-[(6-pyrrolidinopyridin-1-ium-3-yl)methyl]cyclopentanecarboxamide Formula: C24H32N5O2+ MolecularWeight: 422.54318

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)NCC2=C[NH+]=C(C=C2)N3CCCC3)NC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)(C(=O)NCC2=C[NH+]=C(C=C2)N3CCCC3)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C24H31N5O2/c30-22(26-18-20-10-11-21(25-17-20)29-14-6-7-15-29)24(12-4-5-13-24)28-23(31)27-16-19-8-2-1-3-9-19/h1-3,8-11,17H,4-7,12-16,18H2,(H,26,30)(H2,27,28,31)/p+1