N-[(1S)-1-phenylethyl]-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-[(1S)-1-phenylethyl]-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Openeye Name: N-[(1S)-1-phenylethyl]-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide CAS Name: N-[(1S)-1-phenylethyl]-5-(1-pyrrolidin-1-iumylmethyl)-2-furancarboxamide IUPAC Name: N-[(1S)-1-phenylethyl]-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Traditional Name: N-[(1S)-1-phenylethyl]-5-(pyrrolidin-1-ium-1-ylmethyl)-2-furamide Formula: C18H23N2O2+ MolecularWeight: 299.38742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=C(O2)C[NH+]3CCCC3

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)C2=CC=C(O2)C[NH+]3CCCC3

InChI

InChI=1S/C18H22N2O2/c1-14(15-7-3-2-4-8-15)19-18(21)17-10-9-16(22-17)13-20-11-5-6-12-20/h2-4,7-10,14H,5-6,11-13H2,1H3,(H,19,21)/p+1/t14-/m0/s1