3-[(3-bromophenyl)methyl-[(9-ethylcarbazol-3-yl)methyl]amino]propanoic acid

Systemtic Name: 3-[(3-bromophenyl)methyl-[(9-ethylcarbazol-3-yl)methyl]amino]propanoic acid Openeye Name: 3-[(3-bromophenyl)methyl-[(9-ethylcarbazol-3-yl)methyl]amino]propanoic acid CAS Name: 3-[(3-bromophenyl)methyl-[(9-ethyl-3-carbazolyl)methyl]amino]propanoic acid IUPAC Name: 3-[(3-bromophenyl)methyl-[(9-ethylcarbazol-3-yl)methyl]amino]propanoic acid Traditional Name: 3-[(3-bromobenzyl)-[(9-ethylcarbazol-3-yl)methyl]amino]propionic acid Formula: C25H25BrN2O2 MolecularWeight: 465.3822

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)CN(CCC(=O)O)CC3=CC(=CC=C3)Br)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)CN(CCC(=O)O)CC3=CC(=CC=C3)Br)C4=CC=CC=C41

InChI

InChI=1S/C25H25BrN2O2/c1-2-28-23-9-4-3-8-21(23)22-15-19(10-11-24(22)28)17-27(13-12-25(29)30)16-18-6-5-7-20(26)14-18/h3-11,14-15H,2,12-13,16-17H2,1H3,(H,29,30)