1-azanyl-2-methyl-4-[5-[3-(3-methylphenoxy)propyl]thiophen-2-yl]butan-1-ol; ethanedioic acid

Systemtic Name: 1-azanyl-2-methyl-4-[5-[3-(3-methylphenoxy)propyl]thiophen-2-yl]butan-1-ol; ethanedioic acid Openeye Name: 1-amino-2-methyl-4-[5-[3-(3-methylphenoxy)propyl]-2-thienyl]butan-1-ol; oxalic acid CAS Name: 1-amino-2-methyl-4-[5-[3-(3-methylphenoxy)propyl]-2-thiophenyl]-1-butanol; oxalic acid IUPAC Name: 1-amino-2-methyl-4-[5-[3-(3-methylphenoxy)propyl]thiophen-2-yl]butan-1-ol; oxalic acid Traditional Name: 1-amino-2-methyl-4-[5-[3-(3-methylphenoxy)propyl]-2-thienyl]butan-1-ol; oxalic acid Formula: C21H29NO6S MolecularWeight: 423.52306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC2=CC=C(S2)CCC(C)C(N)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC2=CC=C(S2)CCC(C)C(N)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H27NO2S.C2H2O4/c1-14-5-3-6-16(13-14)22-12-4-7-17-10-11-18(23-17)9-8-15(2)19(20)21;3-1(4)2(5)6/h3,5-6,10-11,13,15,19,21H,4,7-9,12,20H2,1-2H3;(H,3,4)(H,5,6)