4-chloranyl-N-[3-[[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]amino]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-chloranyl-N-[3-[[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]amino]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-chloro-N-[3-[[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]amino]-3-oxo-propyl]benzamide CAS Name: 4-chloro-N-[3-[[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]amino]-3-oxopropyl]benzamide IUPAC Name: 4-chloro-N-[3-[[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]amino]-3-oxopropyl]benzamide Traditional Name: 4-chloro-N-[3-[[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]amino]-3-keto-propyl]benzamide Formula: C20H25ClN3O3+ MolecularWeight: 390.8838

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)CCNC(=O)C2=CC=C(C=C2)Cl)C3=CC=CO3

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)CCNC(=O)C2=CC=C(C=C2)Cl)C3=CC=CO3

InChI

InChI=1S/C20H24ClN3O3/c21-16-7-5-15(6-8-16)20(26)22-10-9-19(25)23-14-17(18-4-3-13-27-18)24-11-1-2-12-24/h3-8,13,17H,1-2,9-12,14H2,(H,22,26)(H,23,25)/p+1/t17-/m0/s1