[3-[3-(3-bromophenyl)propylamino]-3-propyl-hex-1-en-2-yl] butanoate

Systemtic Name: [3-[3-(3-bromophenyl)propylamino]-3-propyl-hex-1-en-2-yl] butanoate Openeye Name: [2-[3-(3-bromophenyl)propylamino]-1-methylene-2-propyl-pentyl] butanoate CAS Name: butanoic acid [3-[3-(3-bromophenyl)propylamino]-3-propylhex-1-en-2-yl] ester IUPAC Name: [3-[3-(3-bromophenyl)propylamino]-3-propylhex-1-en-2-yl] butanoate Traditional Name: butyric acid 1-[1-[3-(3-bromophenyl)propylamino]-1-propyl-butyl]vinyl ester Formula: C22H34BrNO2 MolecularWeight: 424.41486

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(=C)C(CCC)(CCC)NCCCC1=CC(=CC=C1)Br

Isomeric SMILES

CCCC(=O)OC(=C)C(CCC)(CCC)NCCCC1=CC(=CC=C1)Br

InChI

InChI=1S/C22H34BrNO2/c1-5-10-21(25)26-18(4)22(14-6-2,15-7-3)24-16-9-12-19-11-8-13-20(23)17-19/h8,11,13,17,24H,4-7,9-10,12,14-16H2,1-3H3