N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxamide Openeye Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-methyl-4-oxo-2-phenyl-chromene-8-carboxamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-3-methyl-4-oxo-2-phenylchromene-8-carboxamide Traditional Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-keto-3-methyl-2-phenyl-chromene-8-carboxamide Formula: C27H27N2O4+ MolecularWeight: 443.51428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NCC(C3=CC=CO3)[NH+]4CCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NC[C@@H](C3=CC=CO3)[NH+]4CCCC4)C5=CC=CC=C5

InChI

InChI=1S/C27H26N2O4/c1-18-24(30)20-11-7-12-21(26(20)33-25(18)19-9-3-2-4-10-19)27(31)28-17-22(23-13-8-16-32-23)29-14-5-6-15-29/h2-4,7-13,16,22H,5-6,14-15,17H2,1H3,(H,28,31)/p+1/t22-/m0/s1