2-[(1R)-1-(3-ethoxy-4-phenylmethoxy-phenyl)-3,9-bis(oxidanylidene)-1H-chromeno[2,3-c]pyrrol-2-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(1R)-1-(3-ethoxy-4-phenylmethoxy-phenyl)-3,9-bis(oxidanylidene)-1H-chromeno[2,3-c]pyrrol-2-yl]ethyl-dimethyl-azanium Openeye Name: 2-[(1R)-1-(4-benzyloxy-3-ethoxy-phenyl)-3,9-dioxo-1H-chromeno[2,3-c]pyrrol-2-yl]ethyl-dimethyl-ammonium CAS Name: 2-[(1R)-1-(3-ethoxy-4-phenylmethoxyphenyl)-3,9-dioxo-1H-[1]benzopyrano[2,3-c]pyrrol-2-yl]ethyl-dimethylammonium IUPAC Name: 2-[(1R)-1-(3-ethoxy-4-phenylmethoxyphenyl)-3,9-dioxo-1H-chromeno[2,3-c]pyrrol-2-yl]ethyl-dimethylazanium Traditional Name: 2-[(1R)-1-(4-benzoxy-3-ethoxy-phenyl)-3,9-diketo-1H-chromeno[2,3-c]pyrrol-2-yl]ethyl-dimethyl-ammonium Formula: C30H31N2O5+ MolecularWeight: 499.57754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C3=C(C(=O)N2CC[NH+](C)C)OC4=CC=CC=C4C3=O)OCC5=CC=CC=C5

Isomeric SMILES

CCOC1=C(C=CC(=C1)[C@@H]2C3=C(C(=O)N2CC[NH+](C)C)OC4=CC=CC=C4C3=O)OCC5=CC=CC=C5

InChI

InChI=1S/C30H30N2O5/c1-4-35-25-18-21(14-15-24(25)36-19-20-10-6-5-7-11-20)27-26-28(33)22-12-8-9-13-23(22)37-29(26)30(34)32(27)17-16-31(2)3/h5-15,18,27H,4,16-17,19H2,1-3H3/p+1/t27-/m1/s1