4-[4-[(E)-2-chloranyl-1,2-diphenyl-ethenyl]phenoxy]-N-propyl-butan-1-amine

Systemtic Name: 4-[4-[(E)-2-chloranyl-1,2-diphenyl-ethenyl]phenoxy]-N-propyl-butan-1-amine Openeye Name: 4-[4-[(E)-2-chloro-1,2-diphenyl-vinyl]phenoxy]-N-propyl-butan-1-amine CAS Name: 4-[4-[(E)-2-chloro-1,2-diphenylethenyl]phenoxy]-N-propyl-1-butanamine IUPAC Name: 4-[4-[(E)-2-chloro-1,2-diphenylethenyl]phenoxy]-N-propylbutan-1-amine Traditional Name: 4-[4-[(E)-2-chloro-1,2-diphenyl-vinyl]phenoxy]butyl-propyl-amine Formula: C27H30ClNO MolecularWeight: 419.9862

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCCCCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CCCNCCCCOC1=CC=C(C=C1)/C(=C(\C2=CC=CC=C2)/Cl)/C3=CC=CC=C3

InChI

InChI=1S/C27H30ClNO/c1-2-19-29-20-9-10-21-30-25-17-15-23(16-18-25)26(22-11-5-3-6-12-22)27(28)24-13-7-4-8-14-24/h3-8,11-18,29H,2,9-10,19-21H2,1H3/b27-26+