ethyl 4-(3,4-dihydro-1H-isochromen-1-ylamino)benzoate

Systemtic Name: ethyl 4-(3,4-dihydro-1H-isochromen-1-ylamino)benzoate Openeye Name: ethyl 4-(isochroman-1-ylamino)benzoate CAS Name: 4-(3,4-dihydro-1H-2-benzopyran-1-ylamino)benzoic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dihydro-1H-isochromen-1-ylamino)benzoate Traditional Name: 4-(isochroman-1-ylamino)benzoic acid ethyl ester Formula: C18H19NO3 MolecularWeight: 297.34836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2C3=CC=CC=C3CCO2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2C3=CC=CC=C3CCO2

InChI

InChI=1S/C18H19NO3/c1-2-21-18(20)14-7-9-15(10-8-14)19-17-16-6-4-3-5-13(16)11-12-22-17/h3-10,17,19H,2,11-12H2,1H3