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

Systemtic Name: 4-[2-(4-methoxyphenyl)-6,7-dimethyl-chromen-4-ylidene]azaniumylbutanoate Openeye Name: 4-[2-(4-methoxyphenyl)-6,7-dimethyl-chromen-4-ylidene]ammoniobutanoate CAS Name: 4-[[2-(4-methoxyphenyl)-6,7-dimethyl-1-benzopyran-4-ylidene]ammonio]butanoate IUPAC Name: 4-[2-(4-methoxyphenyl)-6,7-dimethylchromen-4-ylidene]azaniumylbutanoate Traditional Name: 4-[2-(4-methoxyphenyl)-6,7-dimethyl-chromen-4-ylidene]ammoniobutyrate Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO4/c1-14-11-18-19(23-10-4-5-22(24)25)13-20(27-21(18)12-15(14)2)16-6-8-17(26-3)9-7-16/h6-9,11-13H,4-5,10H2,1-3H3,(H,24,25)