3-[2-(4-chlorophenyl)-6,7-dimethyl-chromen-4-ylidene]azaniumylpropanoate

Systemtic Name: 3-[2-(4-chlorophenyl)-6,7-dimethyl-chromen-4-ylidene]azaniumylpropanoate Openeye Name: 3-[2-(4-chlorophenyl)-6,7-dimethyl-chromen-4-ylidene]ammoniopropanoate CAS Name: 3-[[2-(4-chlorophenyl)-6,7-dimethyl-1-benzopyran-4-ylidene]ammonio]propanoate IUPAC Name: 3-[2-(4-chlorophenyl)-6,7-dimethylchromen-4-ylidene]azaniumylpropanoate Traditional Name: 3-[2-(4-chlorophenyl)-6,7-dimethyl-chromen-4-ylidene]ammoniopropionate Formula: C20H18ClNO3 MolecularWeight: 355.81482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18ClNO3/c1-12-9-16-17(22-8-7-20(23)24)11-18(25-19(16)10-13(12)2)14-3-5-15(21)6-4-14/h3-6,9-11H,7-8H2,1-2H3,(H,23,24)