2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethyl-ethanamine; 2-propylpentanoic acid

Systemtic Name: 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethyl-ethanamine; 2-propylpentanoic acid Openeye Name: 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethyl-ethanamine; 2-propylpentanoic acid CAS Name: 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine; 2-propylpentanoic acid IUPAC Name: 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine; 2-propylpentanoic acid Traditional Name: 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]ethyl-dimethyl-amine; 2-propylvaleric acid Formula: C34H45NO3 MolecularWeight: 515.726

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)O.CCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)OCCN(C)C)C3=CC=CC=C3

Isomeric SMILES

CCCC(CCC)C(=O)O.CC/C(=C(\C1=CC=CC=C1)/C2=CC=C(C=C2)OCCN(C)C)/C3=CC=CC=C3

InChI

InChI=1S/C26H29NO.C8H16O2/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3;1-3-5-7(6-4-2)8(9)10/h5-18H,4,19-20H2,1-3H3;7H,3-6H2,1-2H3,(H,9,10)/b26-25-;