ethanedioic acid; 3-[(7-methoxy-3,4-dihydro-2H-chromen-2-yl)methylamino]propan-1-ol

Systemtic Name: ethanedioic acid; 3-[(7-methoxy-3,4-dihydro-2H-chromen-2-yl)methylamino]propan-1-ol Openeye Name: 3-[(7-methoxychroman-2-yl)methylamino]propan-1-ol; oxalic acid CAS Name: 3-[(7-methoxy-3,4-dihydro-2H-1-benzopyran-2-yl)methylamino]-1-propanol; oxalic acid IUPAC Name: 3-[(7-methoxy-3,4-dihydro-2H-chromen-2-yl)methylamino]propan-1-ol; oxalic acid Traditional Name: 3-[(7-methoxychroman-2-yl)methylamino]propan-1-ol; oxalic acid Formula: C16H23NO7 MolecularWeight: 341.35632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CCC(O2)CNCCCO)C=C1.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC2=C(CCC(O2)CNCCCO)C=C1.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H21NO3.C2H2O4/c1-17-12-5-3-11-4-6-13(18-14(11)9-12)10-15-7-2-8-16;3-1(4)2(5)6/h3,5,9,13,15-16H,2,4,6-8,10H2,1H3;(H,3,4)(H,5,6)