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

Systemtic Name: 2-oxidanylidene-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]chromene-3-carboxamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-oxo-chromene-3-carboxamide CAS Name: 2-oxo-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-1-benzopyran-3-carboxamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-oxochromene-3-carboxamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-keto-chromene-3-carboxamide Formula: C21H21N2O3+ MolecularWeight: 349.40304

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1NC(=O)C2=CC3=CC=CC=C3OC2=O)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](C[C@H]1NC(=O)C2=CC3=CC=CC=C3OC2=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H20N2O3/c24-20(18-12-16-8-4-5-9-19(16)26-21(18)25)22-17-10-11-23(14-17)13-15-6-2-1-3-7-15/h1-9,12,17H,10-11,13-14H2,(H,22,24)/p+1/t17-/m0/s1