2-[2-[2-(4-methoxyphenyl)-6,7-dimethyl-chromen-4-ylidene]azaniumylethanoylamino]ethanoate

Systemtic Name: 2-[2-[2-(4-methoxyphenyl)-6,7-dimethyl-chromen-4-ylidene]azaniumylethanoylamino]ethanoate Openeye Name: 2-[[2-[2-(4-methoxyphenyl)-6,7-dimethyl-chromen-4-ylidene]ammonioacetyl]amino]acetate CAS Name: 2-[[2-[[2-(4-methoxyphenyl)-6,7-dimethyl-1-benzopyran-4-ylidene]ammonio]-1-oxoethyl]amino]acetate IUPAC Name: 2-[[2-[2-(4-methoxyphenyl)-6,7-dimethylchromen-4-ylidene]azaniumylacetyl]amino]acetate Traditional Name: 2-[[2-[2-(4-methoxyphenyl)-6,7-dimethyl-chromen-4-ylidene]ammonioacetyl]amino]acetate Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=[NH+]CC(=O)NCC(=O)[O-])C=C(O2)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=[NH+]CC(=O)NCC(=O)[O-])C=C(O2)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C22H22N2O5/c1-13-8-17-18(23-11-21(25)24-12-22(26)27)10-19(29-20(17)9-14(13)2)15-4-6-16(28-3)7-5-15/h4-10H,11-12H2,1-3H3,(H,24,25)(H,26,27)