2-oxidanylidene-N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]chromene-3-carboxamide

Systemtic Name: 2-oxidanylidene-N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]chromene-3-carboxamide Openeye Name: 2-oxo-N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]chromene-3-carboxamide CAS Name: 2-oxo-N-[(1S)-1-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]-1-benzopyran-3-carboxamide IUPAC Name: 2-oxo-N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-ylethyl]chromene-3-carboxamide Traditional Name: 2-keto-N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]chromene-3-carboxamide Formula: C22H23N2O3+ MolecularWeight: 363.42962

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(C2=CC=CC=C2)NC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

C1CC[NH+](C1)C[C@H](C2=CC=CC=C2)NC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C22H22N2O3/c25-21(18-14-17-10-4-5-11-20(17)27-22(18)26)23-19(15-24-12-6-7-13-24)16-8-2-1-3-9-16/h1-5,8-11,14,19H,6-7,12-13,15H2,(H,23,25)/p+1/t19-/m1/s1