methyl 4-[(2R)-2-(aminomethyl)-3,4-dihydro-2H-chromen-6-yl]benzoate hydrochloride

Systemtic Name: methyl 4-[(2R)-2-(aminomethyl)-3,4-dihydro-2H-chromen-6-yl]benzoate hydrochloride Openeye Name: methyl 4-[(2R)-2-(aminomethyl)chroman-6-yl]benzoate hydrochloride CAS Name: 4-[(2R)-2-(aminomethyl)-3,4-dihydro-2H-1-benzopyran-6-yl]benzoic acid methyl ester hydrochloride IUPAC Name: methyl 4-[(2R)-2-(aminomethyl)-3,4-dihydro-2H-chromen-6-yl]benzoate hydrochloride Traditional Name: 4-[(2R)-2-(aminomethyl)chroman-6-yl]benzoic acid methyl ester hydrochloride Formula: C18H20ClNO3 MolecularWeight: 333.8093

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(CC3)CN.Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)O[C@H](CC3)CN.Cl

InChI

InChI=1S/C18H19NO3.ClH/c1-21-18(20)13-4-2-12(3-5-13)14-7-9-17-15(10-14)6-8-16(11-19)22-17;/h2-5,7,9-10,16H,6,8,11,19H2,1H3;1H/t16-;/m1./s1