2-[[3-(3-azanyl-2-methyl-phenoxy)propylamino]methyl]-3,4-dihydro-2H-chromen-7-ol; ethanedioic acid

Systemtic Name: 2-[[3-(3-azanyl-2-methyl-phenoxy)propylamino]methyl]-3,4-dihydro-2H-chromen-7-ol; ethanedioic acid Openeye Name: 2-[[3-(3-amino-2-methyl-phenoxy)propylamino]methyl]chroman-7-ol; oxalic acid CAS Name: 2-[[3-(3-amino-2-methylphenoxy)propylamino]methyl]-3,4-dihydro-2H-1-benzopyran-7-ol; oxalic acid IUPAC Name: 2-[[3-(3-amino-2-methylphenoxy)propylamino]methyl]-3,4-dihydro-2H-chromen-7-ol; oxalic acid Traditional Name: 2-[[3-(3-amino-2-methyl-phenoxy)propylamino]methyl]chroman-7-ol; oxalic acid Formula: C22H28N2O7 MolecularWeight: 432.46692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1OCCCNCC2CCC3=C(O2)C=C(C=C3)O)N.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=CC=C1OCCCNCC2CCC3=C(O2)C=C(C=C3)O)N.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H26N2O3.C2H2O4/c1-14-18(21)4-2-5-19(14)24-11-3-10-22-13-17-9-7-15-6-8-16(23)12-20(15)25-17;3-1(4)2(5)6/h2,4-6,8,12,17,22-23H,3,7,9-11,13,21H2,1H3;(H,3,4)(H,5,6)