methyl 3-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methylamino]-4-methyl-benzoate Openeye Name: methyl 3-[(7-ethyl-2-oxo-chromen-4-yl)methylamino]-4-methyl-benzoate CAS Name: 3-[(7-ethyl-2-oxo-1-benzopyran-4-yl)methylamino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(7-ethyl-2-oxochromen-4-yl)methylamino]-4-methylbenzoate Traditional Name: 3-[(7-ethyl-2-keto-chromen-4-yl)methylamino]-4-methyl-benzoic acid methyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CNC3=C(C=CC(=C3)C(=O)OC)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CNC3=C(C=CC(=C3)C(=O)OC)C

InChI

InChI=1S/C21H21NO4/c1-4-14-6-8-17-16(11-20(23)26-19(17)9-14)12-22-18-10-15(21(24)25-3)7-5-13(18)2/h5-11,22H,4,12H2,1-3H3