1-(cyclooctylamino)-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propan-2-ol; ethanedioic acid

Systemtic Name: 1-(cyclooctylamino)-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propan-2-ol; ethanedioic acid Openeye Name: 1-(cyclooctylamino)-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propan-2-ol; oxalic acid CAS Name: 1-(cyclooctylamino)-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-2-propanol; oxalic acid IUPAC Name: 1-(cyclooctylamino)-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propan-2-ol; oxalic acid Traditional Name: 1-(cyclooctylamino)-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propan-2-ol; oxalic acid Formula: C23H35NO7 MolecularWeight: 437.5265

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=CC(=C(C=C1)OCC(CNC2CCCCCCC2)O)OC.C(=O)(C(=O)O)O

Isomeric SMILES

C/C=C/C1=CC(=C(C=C1)OCC(CNC2CCCCCCC2)O)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H33NO3.C2H2O4/c1-3-9-17-12-13-20(21(14-17)24-2)25-16-19(23)15-22-18-10-7-5-4-6-8-11-18;3-1(4)2(5)6/h3,9,12-14,18-19,22-23H,4-8,10-11,15-16H2,1-2H3;(H,3,4)(H,5,6)/b9-3+;