methyl 4-[(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methylamino]-3-methyl-benzoate

Systemtic Name: methyl 4-[(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methylamino]-3-methyl-benzoate Openeye Name: methyl 4-[(7,8-dimethyl-2-oxo-chromen-4-yl)methylamino]-3-methyl-benzoate CAS Name: 4-[(7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methylamino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 4-[(7,8-dimethyl-2-oxochromen-4-yl)methylamino]-3-methylbenzoate Traditional Name: 4-[(2-keto-7,8-dimethyl-chromen-4-yl)methylamino]-3-methyl-benzoic acid methyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CNC3=C(C=C(C=C3)C(=O)OC)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CNC3=C(C=C(C=C3)C(=O)OC)C)C

InChI

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